IBS-ZINC02227587 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 41 0 0 0 0 0 0 0 0999 V2000 -0.0080 1.3880 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 1.4240 -1.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 0.7500 -1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 0.0360 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6340 0.0020 1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4300 0.6780 1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6250 -0.6480 -0.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6430 -1.9980 0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6150 -2.6360 0.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9520 -2.6650 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0760 -4.0500 0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3280 -4.6230 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4600 -3.8320 -0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3620 -2.4720 -0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1050 -1.8610 -0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9680 -0.5230 -0.2000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7930 0.0520 -0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7230 1.5220 -0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2410 2.1690 -1.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1740 3.5420 -1.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5940 4.2850 -0.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0780 3.6570 0.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1320 2.2760 0.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 1.6580 1.8570 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 1.9200 0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4130 1.9790 -1.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5590 0.7780 -1.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9750 -0.5520 2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 0.6520 2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1990 -4.6690 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4300 -5.6960 0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4330 -4.2990 -0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2510 -1.8710 -0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6950 1.5940 -2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5740 4.0420 -2.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5460 5.3600 -0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6280 4.2430 1.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2550 1.5450 2.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 24 38 1 0 0 0 0 M END