IBS-ZINC04295546 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3580 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 -0.5160 1.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 0.0300 2.5090 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2460 1.1000 2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 -0.2050 2.4080 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0370 -0.4600 1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3040 -0.6210 1.5200 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5000 -0.4750 2.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3480 -0.2180 3.4170 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7320 -0.5780 3.4930 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8480 -0.8470 2.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7850 -0.9990 1.5860 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1760 -0.9590 3.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2720 -1.2670 2.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5990 -1.3790 3.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3900 -0.2570 3.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6080 -0.3600 3.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0340 -1.5840 4.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2430 -2.7050 4.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0280 -2.6040 3.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 -0.5180 0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 -0.6780 3.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 0.0440 4.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 -0.6050 5.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6000 -1.9760 5.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 -2.6980 4.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 -2.0480 3.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -1.6050 1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 -0.1810 1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7820 -0.4570 4.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1300 -1.7610 4.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4010 -0.0180 3.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3180 -0.4650 1.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0460 -2.2080 1.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0570 0.6990 2.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2260 0.5160 4.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9850 -1.6640 4.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5760 -3.6610 4.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4120 -3.4800 3.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8050 -0.8770 -0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 1.1150 4.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 -0.0420 6.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9920 -2.4840 6.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 -3.7690 5.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -2.6120 3.0670 H 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 23 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 24 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 M END