IBS-ZINC02315049 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 64 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 0 0 0 0 0 0 0 0 0 0 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -1.8400 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -2.5620 -0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 -2.4340 0.0170 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5630 -1.8080 0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4340 -2.5130 -1.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8400 -4.0980 0.7280 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.5590 -4.4830 0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5250 -3.6880 0.3440 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7070 -4.2850 0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4720 -5.5400 1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0950 -5.6500 1.2060 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3630 -6.7990 1.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2110 -6.6430 3.2590 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.1940 -6.5030 3.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5580 -7.8990 3.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5220 -7.8030 5.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9690 -8.8450 5.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4780 -9.9220 5.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9080 -10.9980 5.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 -11.0080 7.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3180 -9.9180 8.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8930 -8.8190 7.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3810 -7.7280 8.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2900 -7.7370 9.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7190 -8.8160 10.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 -9.8960 9.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3910 -5.5070 3.5410 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5620 -6.3840 1.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3790 -7.4880 1.8150 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8120 -5.9600 1.0530 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.5660 -6.5410 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0280 -4.7460 0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1690 -4.3970 0.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0130 -3.9060 0.2420 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.2910 -2.5900 -0.3390 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4360 -2.9430 -1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4720 -1.5110 -1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7740 -3.1400 -2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9140 -7.7150 1.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3770 -6.8500 1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1360 -8.7760 3.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5420 -7.9910 3.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5330 -9.9400 4.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5280 -11.8380 5.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 -11.8510 7.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8250 -6.8850 7.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6660 -6.8960 10.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6600 -8.7980 11.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8080 -10.7250 9.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5010 -5.5630 3.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2850 -2.6640 -1.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2680 -2.2430 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5250 -1.8830 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 42 1 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 8 44 1 0 0 0 0 8 45 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 30 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 22 23 2 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 53 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 26 27 1 0 0 0 0 26 54 1 0 0 0 0 27 28 2 0 0 0 0 27 55 1 0 0 0 0 28 29 1 0 0 0 0 28 56 1 0 0 0 0 29 57 1 0 0 0 0 30 58 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 35 36 2 0 0 0 0 35 37 1 0 0 0 0 37 38 1 0 0 0 0 38 59 1 0 0 0 0 38 60 1 0 0 0 0 38 61 1 0 0 0 0 M END