MMs01425868 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 0.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0047 -1.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0440 -0.9000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3061 -2.2459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6028 -1.4918 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3109 -3.7459 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2919 -2.2541 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.5933 -1.5082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7548 -0.0169 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2230 0.2903 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9689 -1.0111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9617 -2.1226 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2689 -3.5908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1510 -4.5910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7259 -4.1230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6080 -5.1231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9153 -6.5913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3404 -7.0594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4583 -6.0592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4602 -1.1726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3457 0.0381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8370 -0.1234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4428 -1.4956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5572 -2.7064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0660 -2.5449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9340 -1.6571 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0038 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2736 -4.3492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3520 -4.3426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3830 -3.1448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9016 -4.6105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4802 -2.9484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -4.7487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -7.3915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5862 -8.2339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5984 -6.4336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8611 1.1359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5454 0.8452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0419 -3.8042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3576 -3.5134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 M END