IBS-ZINC02195287 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.0220 1.8100 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7600 -0.4360 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 -1.9590 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3970 -2.3230 0.0220 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8830 -1.8420 0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5470 -3.8180 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3340 -4.6660 -0.8240 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5600 -5.9290 -0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4840 -7.1900 -0.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7800 -8.3070 -0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1570 -8.2050 1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2390 -6.9720 1.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9410 -5.8250 0.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9180 -4.4780 1.2700 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2380 -3.8710 2.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7100 -3.5560 2.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6000 -4.4980 3.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9510 -4.2100 3.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4120 -2.9800 2.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5230 -2.0380 2.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1720 -2.3240 2.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0230 -1.8660 -1.2210 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4670 -0.5980 -1.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3490 0.1680 -0.3870 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0930 -0.1400 -2.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5800 1.1160 -2.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1150 1.2730 -4.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0680 0.1850 -4.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3290 -1.1170 -4.0120 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.1870 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1710 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1610 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2260 -0.0280 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2430 -0.0190 -0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4450 -2.3660 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 -2.3760 0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1930 -7.2800 -2.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7210 -9.2800 -0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3880 -9.0980 1.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5330 -6.8980 2.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9830 -4.5660 3.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6650 -2.9510 2.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2390 -5.4590 3.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6460 -4.9460 3.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4680 -2.7550 2.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8840 -1.0770 1.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4760 -1.5870 1.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1170 -2.4760 -1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5490 1.9070 -2.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5420 2.2070 -4.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4430 0.1380 -5.8420 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 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 23 1 0 0 0 0 7 8 2 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 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 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 M END