OTAVA-ZINC02888956 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3060 0.0090 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 1.3170 -0.7400 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 -1.6760 1.1120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 -2.9360 0.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -3.3090 -0.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 -3.8270 2.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 -5.2280 2.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 -5.7780 3.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 -4.6280 4.4700 S 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -3.3520 3.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9330 -2.0760 3.3440 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8760 -1.2690 2.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4640 0.3830 2.4790 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9970 0.3530 4.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5520 1.7020 4.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5850 2.5950 3.7680 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0130 1.9140 5.8360 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9870 1.2000 6.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5540 3.2260 6.2030 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9970 4.0060 5.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4240 3.4250 7.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9660 3.4750 8.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2970 2.3110 8.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 2.3570 8.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 3.5660 8.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 4.7300 8.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2980 4.6850 8.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0070 3.2990 5.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5360 2.3520 5.2770 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 -7.2320 3.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 -7.6160 1.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -6.2450 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 1.8580 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8330 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 -1.2910 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 -0.0240 0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1450 0.1190 4.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7680 -0.4070 4.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9050 2.5960 8.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9050 4.3610 8.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8190 1.3660 8.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4360 1.4470 9.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 3.6020 9.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 5.6760 8.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8220 5.5950 7.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0150 -7.8630 3.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6900 -7.3180 3.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 -8.0470 1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6410 -8.2960 1.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 -6.0670 1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 -6.1940 0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7120 4.4150 6.0510 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6400 4.4140 5.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 13 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 11 2 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 29 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 29 30 2 0 0 0 0 29 54 1 0 0 0 0 31 32 1 0 0 0 0 31 48 1 0 0 0 0 31 49 1 0 0 0 0 32 33 1 0 0 0 0 32 50 1 0 0 0 0 32 51 1 0 0 0 0 33 52 1 0 0 0 0 33 53 1 0 0 0 0 54 55 1 0 0 0 0 M END