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© September 2007; August 2010 Lorentz JÄNTSCHI && Sorana Daniela BOLBOACĂ

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forcefield mm+
sys 0 0 1
view 40 0.10669 55 15 1 0 0 0 1 0 0 0 1 -0.1414 -0.20835 -55
seed -1111
mol 1
atom 1 - C ** - 0 -3.0642 0.9751 0.0097 2 2 s 6 d
atom 2 - C ** - 0 -3.0526 2.3435 0.0027 3 1 s 3 d 23 s
atom 3 - C ** - 0 -2.032 2.8966 0.0022 2 2 d 4 s
atom 4 - C ** - 0 -0.9637 2.0798 -0.0104 2 3 s 5 d
atom 5 - C ** - 0 -0.8831 1.0278 0.021 3 4 d 6 s 7 s
atom 6 - C ** - 0 -2.1758 0.3776 0.027 2 1 d 5 s
atom 7 - C ** - 0 1.3049 0.4747 -0.0869 3 5 s 8 s 14 d
atom 8 - C ** - 0 1.2771 -1.1616 -0.3037 3 7 s 9 s 13 d
atom 9 - C ** - 0 2.0819 -2.2287 -0.1017 2 8 s 10 d
atom 10 - C ** - 0 1.9417 -3.344 -0.0199 2 9 d 11 s
atom 11 - C ** - 0 0.677 -3.9758 0.0022 3 10 s 12 d 24 s
atom 12 - C ** - 0 -0.5108 -3.1192 -0.0336 2 11 d 13 s
atom 13 - C ** - 0 -0.133 -0.3439 -0.279 2 8 d 12 s
atom 14 - C ** - 0 2.1769 1.004599 0.0511 3 7 d 15 s 21 s
atom 15 - C ** - 0 2.0777 2.565 0.0331 3 14 s 16 d 20 s
atom 16 - C ** - 0 3.0961 3.1485 0.0066 2 15 d 17 s
atom 17 - C ** - 0 3.0429 4.5111 -0.008 2 16 s 18 d
atom 18 - C ** - 0 1.8327 5.2487 0.0064 2 17 d 19 s
atom 19 - C ** - 0 0.8293 4.6991 -0.0063 2 18 s 20 d
atom 20 - C ** - 0 0.8792 3.6048 -0.0003 2 15 s 19 d
atom 21 - C ** - 0 3.6237 0.282 -0.0489 2 14 s 22 t
atom 22 - N ** - 0 4.608 -0.1689 -0.0437 1 21 t
atom 23 - O ** - 0 -4.3952 3.1427 -0.0059 1 2 s
atom 24 - C ** - 0 0.7028 -5.5671 0.0016 1 11 s
endmol 1