IBS-ZINC02111300 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 63 0 0 1 0 0 0 0 0999 V2000 -4.1710 2.0500 0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7780 0.6160 0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1040 0.0040 1.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7430 -1.3120 1.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0560 -2.0150 0.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7300 -1.4020 -0.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0950 -0.0880 -0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5950 -3.6910 1.0720 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4890 -3.9540 0.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5460 -3.8590 2.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8390 -4.6410 0.5310 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1560 -4.6880 -0.8980 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4780 -4.0320 -1.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9980 -6.1220 -1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5280 -6.5350 -1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8440 -7.0640 -0.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5760 -4.2320 -1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3760 -4.2880 -0.2030 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9580 -3.7610 -2.3170 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3130 -3.2290 -2.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2070 -1.8200 -3.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3570 -1.8680 -4.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9470 -2.3540 -4.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0260 -3.7640 -3.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2780 -0.4900 -4.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5690 0.4820 -4.3190 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8860 -0.3360 -6.2650 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6100 -1.5130 -7.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7340 1.0080 -6.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3240 1.4910 -6.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5280 0.7850 -6.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3740 2.7100 0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3350 2.2060 -0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0880 2.2730 0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6410 0.5530 2.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9970 -1.7900 2.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1930 -1.9520 -1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8440 0.3890 -1.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3580 -5.1660 1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3310 -6.1770 -2.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2240 -6.5790 -0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3990 -7.5160 -1.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9140 -5.8040 -1.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9000 -6.8290 -0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6600 -8.0950 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5750 -6.9410 0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8610 -3.8740 -3.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8340 -3.1850 -1.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2040 -1.4510 -3.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7400 -1.1540 -2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8120 -2.5530 -5.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3350 -2.3660 -4.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5010 -1.6840 -3.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0370 -4.0730 -3.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3830 -4.4530 -4.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5410 -1.8760 -7.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9170 -1.2430 -7.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1690 -2.2960 -6.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9400 0.9790 -7.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4330 1.6870 -6.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9530 2.7050 -7.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0380 2.9710 -6.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 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 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 40 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 29 30 1 0 0 0 0 29 59 1 0 0 0 0 29 60 1 0 0 0 0 30 31 2 0 0 0 0 30 61 1 0 0 0 0 61 62 1 0 0 0 0 M END