IFLAB-ZINC04138123 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7800 1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.1710 0.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -3.4080 1.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -4.5590 0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -4.5080 -0.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -3.2990 -1.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.1140 -0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.7840 -1.1220 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -0.4480 -2.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -5.8930 1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2800 -6.3440 1.4850 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5050 -7.5210 2.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 -8.2080 2.4600 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8910 -7.9760 2.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1270 -9.1940 2.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4230 -9.6130 3.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4860 -8.8280 2.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2590 -7.6190 2.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9680 -7.1870 1.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1380 -9.3710 3.0860 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.9510 -8.7090 2.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0800 -10.7850 3.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5940 -8.7880 4.5670 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.2410 -7.4740 4.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5560 -7.6410 5.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2760 -8.3290 6.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6850 -9.7180 6.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3650 -9.5780 5.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.4440 2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -3.4550 2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -5.4260 -1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -3.2700 -2.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6100 -6.6210 0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 -5.7950 2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0280 -5.7960 1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2980 -9.8080 3.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6070 -10.5550 3.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0940 -7.0120 1.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7920 -6.2410 1.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5850 -6.7920 5.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4470 -7.0760 3.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9980 -6.6610 5.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2450 -8.2500 4.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5680 -7.7320 7.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2060 -8.4270 7.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5070 -10.2170 7.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3820 -10.3070 5.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9930 -10.5660 5.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6370 -9.0710 6.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 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 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 M END