COMGENEX-ZINC06777691 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -0.3670 1.6770 0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 0.2150 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 0.0570 -1.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 -0.2060 1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -0.2330 2.4500 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8040 -0.8500 2.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 -0.8110 3.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3680 -0.0790 4.4220 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 -2.1420 3.6510 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 -2.7380 4.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 -3.8850 5.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 -4.1700 3.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -3.0360 2.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -6.0190 4.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3310 1.1300 2.7920 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7470 1.4640 3.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3660 1.0220 2.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7650 3.2980 2.8820 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 3.4740 3.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5650 2.1010 2.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7520 1.9010 2.7840 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2060 1.0120 4.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3370 1.0620 5.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7560 0.6470 6.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0480 0.1810 6.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9190 0.1300 5.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4990 0.5510 4.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3500 0.5060 3.4910 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.4580 -0.2250 8.0860 F 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 2.2850 0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8440 2.0270 -0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 1.7620 0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 -0.4150 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7280 0.6860 -1.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 -0.9850 -1.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 0.3560 -2.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 -1.1990 0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 0.5070 1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7570 -3.1250 4.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9220 -1.9850 5.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4710 -4.4090 6.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -3.4820 5.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0930 -3.7630 3.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 -4.9010 2.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -2.4780 1.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4870 -3.4510 2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9900 -5.7320 5.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5870 -6.5230 5.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 -6.6940 3.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 4.2420 2.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 3.6910 4.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3290 1.4260 5.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 0.6860 7.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9270 -0.2330 5.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -4.8190 4.2560 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 15 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 11 55 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 12 55 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 47 1 0 0 0 0 14 48 1 0 0 0 0 14 49 1 0 0 0 0 14 55 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 22 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 25 26 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 M END