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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 0.10406 55 15 0.22257 -0.3910765 -0.8930407 0.3872733 0.8761097 -0.2871431 0.8946966 -0.2819414 0.3464492 0.026377 0.16731 -54.389
seed -1111
mol 1
atom 1 - C ** - 0 -3.1347 1.0495 0.0141 2 2 s 6 d
atom 2 - C ** - 0 -3.1067 2.3564 -0.0074 3 1 s 3 d 23 s
atom 3 - C ** - 0 -1.996 2.9032 0.0176 2 2 d 4 s
atom 4 - C ** - 0 -0.9986 2.1086 0.1168 2 3 s 5 d
atom 5 - C ** - 0 -1.0799 1.0639 0.2415 3 4 d 6 s 7 s
atom 6 - C ** - 0 -2.3119 0.5103 -0.0325999 2 1 d 5 s
atom 7 - C ** - 0 0.8167 0.0438 0.1779 3 5 s 8 s 14 d
atom 8 - C ** - 0 1.1095 -1.8252 0.1318 3 7 s 9 s 13 d
atom 9 - C ** - 0 2.0272 -2.8274 -0.2407 2 8 s 10 d
atom 10 - C ** - 0 2.0045 -3.625099 -0.159 2 9 d 11 s
atom 11 - C ** - 0 0.7418 -4.2128 -0.0356 3 10 s 12 d 24 s
atom 12 - C ** - 0 -0.8528 -3.1724 0.0204 2 11 d 13 s
atom 13 - C ** - 0 -1.1078 -0.1684 0.1885 2 8 d 12 s
atom 14 - C ** - 0 2.3931 0.9447 0.1716 3 7 d 15 s 21 s
atom 15 - C ** - 0 2.383 2.6297 0.0825 3 14 s 16 d 20 s
atom 16 - C ** - 0 3.3098 3.1923 -0.0001 2 15 d 17 s
atom 17 - C ** - 0 3.1672 4.6168 0.0011 2 16 s 18 d
atom 18 - C ** - 0 1.9195 5.3017 -0.0027 2 17 d 19 s
atom 19 - C ** - 0 0.999 4.705999 0.0081 2 18 s 20 d
atom 20 - C ** - 0 1.1294 3.5663 0.0185 2 15 s 19 d
atom 21 - C ** - 0 3.4947 0.2124 0.0155 2 14 s 22 t
atom 22 - N ** - 0 4.4325 -0.3731 0.0284 1 21 t
atom 23 - O ** - 0 -4.4721 3.1492 0.0214 1 2 s
atom 24 - C ** - 0 0.7793 -5.8929 -0.0294 1 11 s
endmol 1