Up
forcefield mm+
sys 0 0 1
view 40 0.11859 55 15 -0.8777574 -0.3190212 -0.3574458 -0.2271261 0.9339832 -0.2758427 0.421848 -0.1609377 -0.8922687 0.37234 0.15199 -54.888
seed 0
mol 1
atom 1 - C ** - -0.1093554 -0.01393265 -1.085433 -0.05923375 2 2 s 6 d
atom 2 - C ** - 0.1300807 1.269483 -1.645887 -0.1617307 3 1 s 3 d 14 s
atom 3 - C ** - -0.1885076 2.422471 -0.8324784 -0.1493842 2 2 d 4 s
atom 4 - C ** - 0.02223468 2.312138 0.5426533 -0.06049551 2 3 s 5 d
atom 5 - C ** - -0.1496015 1.032345 1.112215 -0.007316261 3 4 d 6 s 8 s
atom 6 - C ** - -0.1715436 -0.1303518 0.3023026 -4.398275e-005 3 1 d 5 s 7 s
atom 7 - S ** - 0.2782264 -1.556521 1.320148 0.04053183 2 6 s 9 s
atom 8 - N ** - 0.08943558 0.7590315 2.498459 0.008513893 2 5 s 9 d
atom 9 - C ** - -0.6458559 -0.5324706 2.776838 0.0181236 3 7 s 8 d 10 s
atom 10 - S ** - 2.261895 -1.021206 4.536466 0.006603702 4 9 s 11 d 12 s 13 d
atom 11 - O ** - -0.792501 -0.5088324 5.188167 -1.174518 1 10 d
atom 12 - N ** - -0.4417844 -2.767557 4.471323 -0.1518297 1 10 s
atom 13 - O ** - -0.8381834 -0.7558653 5.110526 1.307644 1 10 d
atom 14 - O ** - -0.1912308 1.290811 -3.010589 -0.3500238 2 2 s 15 s
atom 15 - C ** - 0.05320454 2.501286 -3.723912 -0.08848364 2 14 s 16 s
atom 16 - C ** - -0.1339931 2.224956 -4.814326 0.9329505 1 15 s
endmol 1
Powered by
