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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 0.099466 55 15 -0.4667568 -0.8179402 0.3363211 0.8398338 -0.5291208 -0.121286 0.2771592 0.2258428 0.9339046 0.19297 0.73871 -55.102
seed -1111
mol 1
atom 1 - C ** - 0 -3.5512 0.4971 -0.0159 2 2 s 6 d
atom 2 - C ** - 0 -3.491 1.8281 0.00479999 2 1 s 3 d
atom 3 - C ** - 0 -2.4581 2.3944 0.0106 2 2 d 4 s
atom 4 - C ** - 0 -1.3393 1.5692 0.0699 2 3 s 5 d
atom 5 - C ** - 0 -1.2521 0.3959 -0.0034 3 4 d 6 s 7 s
atom 6 - C ** - 0 -2.8002 -0.0115999 -0.0402 2 1 d 5 s
atom 7 - C ** - 0 0.258 -0.1863 0.0182 3 5 s 8 s 14 d
atom 8 - C ** - 0 -0.0346 -1.1657 -0.0782 3 7 s 9 s 13 d
atom 9 - C ** - 0 1.7784 -2.9255 -0.0682 2 8 s 10 d
atom 10 - C ** - 0 1.5479 -4.0616 -0.0363 2 9 d 11 s
atom 11 - C ** - 0 0.332 -4.6189 0.0036 3 10 s 12 d 23 s
atom 12 - C ** - 0 -1.1504 -3.6956 0.0212 2 11 d 13 s
atom 13 - C ** - 0 -1.6497 -0.6834 0.2611 2 8 d 12 s
atom 14 - C ** - 0 1.8513 0.2904 0.1399 3 7 d 15 s 21 s
atom 15 - C ** - 0 1.8333 1.871 0.2224 3 14 s 16 d 20 s
atom 16 - C ** - 0 2.8232 2.5531 0.1151 2 15 d 17 s
atom 17 - C ** - 0 2.7031 3.9348 -0.0083 2 16 s 18 d
atom 18 - C ** - 0 1.4989 4.6334 0.0046 3 17 d 19 s 24 s
atom 19 - C ** - 0 0.5083 4.0321 0.0318 2 18 s 20 d
atom 20 - C ** - 0 0.6991 2.8378 -0.0682 2 15 s 19 d
atom 21 - C ** - 0 3.2658 -0.3631 -0.0337999 2 14 s 22 t
atom 22 - N ** - 0 4.3327 -0.7958 -0.1561 1 21 t
atom 23 - O ** - 0 0.3178 -6.1443 -0.0066 1 11 s
atom 24 - O ** - 0 1.505399 6.2129 -0.0009 1 18 s
endmol 1