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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 0.106 55 15 0.4471581 -0.2774799 -0.8503261 -0.8685398 -0.36188 -0.3386467 -0.2137483 0.8899707 -0.4028199 0.70556 0.82755 -54.335
seed -1111
mol 1
atom 1 - C ** - 0 -2.8946 0.8423 0.0108 2 2 s 6 d
atom 2 - C ** - 0 -2.8894 2.1849 0.0033 3 1 s 3 d 23 s
atom 3 - C ** - 0 -1.8819 2.7377 0.0203 2 2 d 4 s
atom 4 - C ** - 0 -0.9505 1.9236 -0.0277 2 3 s 5 d
atom 5 - C ** - 0 -0.7457 0.9188 -0.0099 3 4 d 6 s 7 s
atom 6 - C ** - 0 -2.049599 0.173 0.064 2 1 d 5 s
atom 7 - C ** - 0 0.7152 0.693 -0.0373 3 5 s 8 s 14 d
atom 8 - C ** - 0 1.1461 -1.9362 0.0148 3 7 s 9 s 13 d
atom 9 - C ** - 0 2.0947 -2.9315 0.0453 2 8 s 10 d
atom 10 - C ** - 0 1.9674 -3.931899 0.0028 2 9 d 11 s
atom 11 - C ** - 0 0.7889 -4.3357 0.0188 3 10 s 12 d 24 s
atom 12 - C ** - 0 -0.4047 -3.2353 0.0528 2 11 d 13 s
atom 13 - C ** - 0 -0.1972 -0.579 0.1493 2 8 d 12 s
atom 14 - C ** - 0 1.9748 0.8267 -0.0412 3 7 d 15 s 21 s
atom 15 - C ** - 0 1.772 2.6032 -0.0531 3 14 s 16 d 20 s
atom 16 - C ** - 0 3.0916 3.0662 0.0031 2 15 d 17 s
atom 17 - C ** - 0 3.2255 4.3389 0.0004 2 16 s 18 d
atom 18 - C ** - 0 2.029599 5.0887 0.0009 2 17 d 19 s
atom 19 - C ** - 0 0.9474 4.5623 -0.0178 2 18 s 20 d
atom 20 - C ** - 0 0.9183 3.5038 0.0315 2 15 s 19 d
atom 21 - C ** - 0 3.4686 0.0587 -0.0066 2 14 s 22 t
atom 22 - N ** - 0 4.5577 -0.2863 0.0158 1 21 t
atom 23 - C ** - 0 -4.2003 2.9945 0.0029 1 2 s
atom 24 - O ** - 0 0.7852 -5.8072 -0.0032 1 11 s
endmol 1