Output Message

Welcome to antechamber 20.0: molecular input file processor. Warning: Detected more than 10 Residue sequence numbers; this may be a large multiple residue PDB file; large multiple residue PDB files are not supported. This warning usually indicates a conceptual misunderstanding. We recommend reviewing the Information flow in Amber documentation and the antechamber tutorials. Continuing, but problems may be encountered. Info: The number of atoms (2560) exceeded MAXATOM. Warning: Detected more than 10 Residue sequence numbers; this may be a large multiple residue PDB file; large multiple residue PDB files are not supported. This warning usually indicates a conceptual misunderstanding. We recommend reviewing the Information flow in Amber documentation and the antechamber tutorials. Continuing, but problems may be encountered. Info: The bond number exceeds MAXBOND, reallocate memory automatically Info: The number of atoms (2560) exceeded MAXATOM. Info: The number of rings (44532) exceeded the default (1000). Warning: For atom (ID: 817, Name: Na) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 818, Name: Na) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 819, Name: Na) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 820, Name: Na) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 821, Name: Na) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 822, Name: Na) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 823, Name: Na) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 824, Name: Na) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 825, Name: Na1) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 826, Name: Na2) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 827, Name: Na3) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1073, Name: O870) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1076, Name: O871) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1085, Name: O874) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1091, Name: O876) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1103, Name: O880) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1118, Name: O885) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1130, Name: O889) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1136, Name: O891) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1142, Name: O893) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1151, Name: O896) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1154, Name: O897) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1157, Name: O898) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1160, Name: O899) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1163, Name: O900) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1166, Name: O901) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1187, Name: O908) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1190, Name: O909) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1193, Name: O910) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1196, Name: O911) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1199, Name: O912) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1202, Name: O913) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1205, Name: O914) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1214, Name: O917) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1217, Name: O918) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1220, Name: O919) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1223, Name: O920) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1226, Name: O921) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1244, Name: O927) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1250, Name: O929) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1256, Name: O931) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1259, Name: O932) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1265, Name: O934) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1268, Name: O935) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1271, Name: O936) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1277, Name: O938) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1286, Name: O941) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1292, Name: O943) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1298, Name: O945) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1301, Name: O946) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1310, Name: O949) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1313, Name: O950) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1322, Name: O953) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1328, Name: O955) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1331, Name: O956) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1334, Name: O957) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1340, Name: O959) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1343, Name: O960) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1352, Name: O963) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1358, Name: O965) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1361, Name: O966) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1364, Name: O5) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1367, Name: O6) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1373, Name: O8) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1382, Name: O11) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1385, Name: O12) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1388, Name: O13) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1391, Name: O14) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1394, Name: O15) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1397, Name: O16) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1403, Name: O18) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1409, Name: O20) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1418, Name: O23) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1421, Name: O24) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1424, Name: O25) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1430, Name: O27) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1433, Name: O28) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1436, Name: O29) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1439, Name: O30) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1445, Name: O32) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1448, Name: O33) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1451, Name: O34) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1454, Name: O35) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1457, Name: O36) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1466, Name: O39) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1469, Name: O40) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1472, Name: O41) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1484, Name: O45) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1487, Name: O46) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1493, Name: O48) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1496, Name: O49) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1499, Name: O50) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1505, Name: O52) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1517, Name: O56) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1520, Name: O57) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1523, Name: O58) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1526, Name: O59) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1535, Name: O62) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1538, Name: O63) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1541, Name: O64) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1544, Name: O65) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1556, Name: O69) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1559, Name: O70) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1562, Name: O71) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1565, Name: O72) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1571, Name: O74) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1577, Name: O76) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1583, Name: O78) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1586, Name: O79) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1592, Name: O81) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1595, Name: O82) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1604, Name: O85) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1607, Name: O86) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1610, Name: O87) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1613, Name: O88) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1616, Name: O89) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1628, Name: O93) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1631, Name: O94) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1634, Name: O95) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1637, Name: O96) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1640, Name: O97) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1643, Name: O98) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1649, Name: O100) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1652, Name: O101) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1655, Name: O102) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1658, Name: O103) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1664, Name: O114) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1670, Name: O116) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1673, Name: O117) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1676, Name: O118) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1691, Name: O123) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1694, Name: O124) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1697, Name: O125) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1703, Name: O127) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1706, Name: O128) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1712, Name: O130) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1727, Name: O135) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1730, Name: O136) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1739, Name: O139) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1742, Name: O140) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1745, Name: O141) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1757, Name: O145) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1760, Name: O146) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1763, Name: O147) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1766, Name: O148) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1772, Name: O150) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1775, Name: O151) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1781, Name: O153) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1787, Name: O155) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1790, Name: O156) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1793, Name: O157) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1796, Name: O158) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1799, Name: O159) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1802, Name: O160) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1805, Name: O161) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1814, Name: O164) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1817, Name: O165) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1820, Name: O166) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1826, Name: O168) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1835, Name: O171) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1838, Name: O172) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1856, Name: O178) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1862, Name: O180) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1868, Name: O182) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1880, Name: O186) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1886, Name: O188) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1889, Name: O189) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1892, Name: O190) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1895, Name: O191) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1898, Name: O192) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1907, Name: O195) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1919, Name: O199) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1922, Name: O200) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1928, Name: O202) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1946, Name: O208) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1952, Name: O210) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1958, Name: O212) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1961, Name: O213) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1967, Name: O224) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1973, Name: O226) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1976, Name: O227) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1979, Name: O228) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1982, Name: O229) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1985, Name: O230) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1988, Name: O231) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1991, Name: O232) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 1997, Name: O234) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2012, Name: O239) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2018, Name: O241) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2024, Name: O243) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2027, Name: O244) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2033, Name: O246) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2036, Name: O247) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2039, Name: O248) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2042, Name: O249) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2045, Name: O250) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2048, Name: O251) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2057, Name: O254) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2060, Name: O255) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2063, Name: O256) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2066, Name: O257) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2072, Name: O259) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2078, Name: O261) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2090, Name: O265) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2093, Name: O266) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2099, Name: O268) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2102, Name: O269) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2108, Name: O271) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2111, Name: O272) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2114, Name: O273) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2117, Name: O274) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2120, Name: O275) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2123, Name: O276) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2129, Name: O278) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2132, Name: O279) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2135, Name: O280) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2150, Name: O285) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2153, Name: O286) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2156, Name: O287) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2159, Name: O288) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2162, Name: O289) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2168, Name: O291) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2177, Name: O294) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2180, Name: O295) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2186, Name: O297) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2189, Name: O298) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2192, Name: O299) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2195, Name: O300) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2198, Name: O301) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2201, Name: O302) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2210, Name: O305) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2213, Name: O306) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2219, Name: O308) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2237, Name: O314) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2243, Name: O316) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2246, Name: O317) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2255, Name: O320) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2258, Name: O321) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2261, Name: O322) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2264, Name: O332) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2267, Name: O333) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2270, Name: O334) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2273, Name: O335) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2276, Name: O336) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2279, Name: O337) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2282, Name: O338) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2288, Name: O340) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2291, Name: O341) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2297, Name: O343) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2303, Name: O345) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2306, Name: O346) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2309, Name: O347) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2312, Name: O348) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2315, Name: O349) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2318, Name: O350) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2327, Name: O353) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2330, Name: O354) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2333, Name: O355) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2336, Name: O356) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2339, Name: O357) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2342, Name: O358) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2357, Name: O363) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2360, Name: O364) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2381, Name: O371) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2384, Name: O372) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2387, Name: O373) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2390, Name: O374) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2396, Name: O376) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2399, Name: O377) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2402, Name: O378) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2405, Name: O379) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2408, Name: O380) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2411, Name: O381) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2417, Name: O383) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2423, Name: O385) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2426, Name: O386) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2429, Name: O387) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2432, Name: O388) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2435, Name: O389) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2438, Name: O390) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2444, Name: O392) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2447, Name: O393) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2450, Name: O394) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2453, Name: O395) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2462, Name: O398) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2474, Name: O402) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2483, Name: O405) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2492, Name: O408) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2498, Name: O410) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2501, Name: O411) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2507, Name: O413) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2510, Name: O414) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2516, Name: O416) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2519, Name: O417) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2525, Name: O419) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2528, Name: O420) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2540, Name: O424) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2546, Name: O426) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2549, Name: O427) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2555, Name: O429) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2558, Name: O430) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2561, Name: O431) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2573, Name: O444) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2576, Name: O445) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2579, Name: O446) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2582, Name: O447) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2585, Name: O448) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2588, Name: O449) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2591, Name: O450) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2594, Name: O451) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2597, Name: O452) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2600, Name: O453) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2603, Name: O454) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2606, Name: O455) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2615, Name: O458) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2618, Name: O459) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2621, Name: O460) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2624, Name: O461) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2627, Name: O462) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2630, Name: O463) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2639, Name: O466) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2642, Name: O467) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2645, Name: O468) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2651, Name: O470) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2660, Name: O473) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2663, Name: O474) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2672, Name: O477) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2678, Name: O479) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2687, Name: O482) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2690, Name: O483) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2693, Name: O484) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2696, Name: O485) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2699, Name: O486) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2702, Name: O487) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2705, Name: O488) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2708, Name: O489) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2711, Name: O490) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2723, Name: O494) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2726, Name: O495) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2729, Name: O496) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2732, Name: O497) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2747, Name: O502) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2750, Name: O503) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2759, Name: O506) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2762, Name: O507) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2765, Name: O508) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2771, Name: O510) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2777, Name: O512) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2780, Name: O513) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2789, Name: O516) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2792, Name: O517) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2795, Name: O518) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2798, Name: O519) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2801, Name: O520) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2810, Name: O523) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2813, Name: O524) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2816, Name: O525) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2819, Name: O526) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2822, Name: O527) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2828, Name: O529) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2831, Name: O530) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2834, Name: O531) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2840, Name: O533) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2843, Name: O534) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2858, Name: O539) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2861, Name: O540) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2864, Name: O550) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2867, Name: O551) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2870, Name: O552) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2876, Name: O554) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2879, Name: O555) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2882, Name: O556) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2888, Name: O558) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2891, Name: O559) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2897, Name: O561) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2903, Name: O563) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2909, Name: O565) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2936, Name: O574) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2939, Name: O575) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2945, Name: O577) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2951, Name: O579) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2957, Name: O581) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2966, Name: O584) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2972, Name: O586) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2975, Name: O587) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2978, Name: O588) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2987, Name: O591) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2990, Name: O592) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2993, Name: O593) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 2996, Name: O594) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3005, Name: O597) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3008, Name: O598) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3011, Name: O599) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3017, Name: O601) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3020, Name: O602) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3026, Name: O604) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3029, Name: O605) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3038, Name: O608) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3041, Name: O609) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3047, Name: O611) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3053, Name: O613) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3056, Name: O614) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3059, Name: O615) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3068, Name: O618) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3071, Name: O619) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3074, Name: O620) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3083, Name: O623) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3086, Name: O624) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3089, Name: O625) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3092, Name: O626) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3095, Name: O627) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3098, Name: O628) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3107, Name: O631) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3110, Name: O632) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3113, Name: O633) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3116, Name: O634) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3119, Name: O635) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3122, Name: O636) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3128, Name: O638) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3137, Name: O641) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3146, Name: O644) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3152, Name: O646) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3167, Name: O660) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3170, Name: O661) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3173, Name: O662) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3182, Name: O665) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3185, Name: O666) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3188, Name: O667) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3197, Name: O670) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3200, Name: O671) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3206, Name: O673) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3212, Name: O675) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3215, Name: O676) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3218, Name: O677) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3221, Name: O678) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3224, Name: O679) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3227, Name: O680) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3230, Name: O681) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3233, Name: O682) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3239, Name: O684) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3242, Name: O685) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3245, Name: O686) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3248, Name: O687) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3254, Name: O689) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3257, Name: O690) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3260, Name: O691) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3263, Name: O692) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3266, Name: O693) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3269, Name: O694) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3272, Name: O695) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3275, Name: O696) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3284, Name: O699) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3287, Name: O700) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3305, Name: O706) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3311, Name: O708) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3317, Name: O710) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3320, Name: O711) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3323, Name: O712) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3335, Name: O716) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3338, Name: O717) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3341, Name: O718) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3344, Name: O719) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3347, Name: O720) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3350, Name: O721) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3353, Name: O722) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3356, Name: O723) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3359, Name: O724) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3362, Name: O725) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3365, Name: O726) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3377, Name: O730) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3380, Name: O731) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3383, Name: O732) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3389, Name: O734) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3401, Name: O738) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3404, Name: O739) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3407, Name: O740) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3413, Name: O742) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3416, Name: O743) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3419, Name: O744) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3422, Name: O745) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3428, Name: O747) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3431, Name: O748) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3437, Name: O750) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3455, Name: O756) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3464, Name: O768) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3470, Name: O770) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3476, Name: O772) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3485, Name: O775) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3497, Name: O779) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3500, Name: O780) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3521, Name: O787) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3524, Name: O788) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3527, Name: O789) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3536, Name: O792) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3539, Name: O793) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3545, Name: O795) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3557, Name: O799) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3560, Name: O800) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3563, Name: O801) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3569, Name: O803) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3572, Name: O804) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3593, Name: O811) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3599, Name: O813) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3617, Name: O819) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3623, Name: O821) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3629, Name: O823) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3632, Name: O824) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3650, Name: O830) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3656, Name: O832) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3677, Name: O839) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3680, Name: O840) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3683, Name: O841) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3689, Name: O843) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3692, Name: O844) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3701, Name: O847) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3707, Name: O849) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3710, Name: O850) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3713, Name: O851) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3725, Name: O855) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3737, Name: O859) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3749, Name: O863) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3752, Name: O864) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3764, Name: O967) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3767, Name: O968) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3770, Name: O969) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3779, Name: O972) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3794, Name: O977) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3815, Name: O984) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3830, Name: O989) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3839, Name: O992) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3842, Name: O993) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3980, Name: O103) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 3983, Name: O104) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 4064, Name: O106) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 4067, Name: O106) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 4073, Name: O107) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 4076, Name: O107) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 4079, Name: O107) the best APS is not zero. Bonds involving this atom are frozen. Warning: For atom (ID: 4082, Name: O107) the best APS is not zero. Bonds involv