CHEMDIV-ZINC06901512 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 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 3 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 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 -1.2130 2.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 -0.1610 1.4260 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 -0.6470 2.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1410 -0.1250 2.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4470 1.0860 3.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7610 1.5270 3.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7160 0.7490 2.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3880 -0.3980 1.9790 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1500 -0.8500 1.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2940 -0.2630 0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4520 -0.8740 0.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2560 -1.5710 -0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9300 -1.3040 -0.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4490 -1.8360 -2.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2740 -2.6130 -2.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5820 -2.8710 -2.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0720 -2.3650 -1.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6150 -3.8670 -3.5780 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.9540 -3.5120 -3.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0780 -3.7850 -4.8910 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4190 -5.4370 -3.0900 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2150 -6.1200 -2.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6600 -7.5530 -1.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2190 -7.4220 -2.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4230 -6.3850 -3.6220 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 2.4760 0.4060 0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 -0.2950 3.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7420 -1.7360 2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6800 1.6730 3.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0350 2.4660 3.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7420 1.0860 2.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9210 -1.7970 1.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1170 0.3360 1.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3570 -0.8560 1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 -1.6410 -2.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8980 -3.0250 -3.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0910 -2.5680 -1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1170 -5.5950 -1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2620 -6.1540 -2.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6400 -7.8640 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2450 -8.2500 -2.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5370 -7.0430 -1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8670 -8.3720 -2.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8040 -6.8720 -4.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4870 -5.8700 -3.8380 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 2 4 1 0 0 0 0 2 14 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 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 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 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 27 1 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 M END