IBS-ZINC02385093 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5260 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -2.3440 0.0240 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.1400 -2.6730 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5550 -3.9340 0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8450 -4.2290 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7940 -3.1720 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2490 -3.2280 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8370 -2.0290 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6540 -0.7360 0.0410 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.3090 -1.8650 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9840 -1.6590 0.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.3440 -1.8380 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9550 -3.0830 0.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.4880 -4.1940 -0.3740 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.0490 -4.5240 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5280 -3.8350 -1.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3840 -5.4070 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7950 -5.1190 -0.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2640 -5.5470 0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2820 -6.6270 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0030 -7.9760 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8400 -8.0900 -1.2330 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5620 -9.3210 -1.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 1.8850 -0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 1.8790 0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 -0.3580 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 -0.3630 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9500 -0.1800 0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9540 -0.1750 -0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6150 -1.0750 0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6780 -1.5330 -0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6160 -5.2240 -0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0410 -4.9630 1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8880 -2.9720 -2.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1720 -4.6820 -2.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5520 -3.5970 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9770 -6.2750 -0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4240 -5.6080 0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2010 -4.2500 -0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7550 -4.9180 -1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4330 -5.9830 -0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2080 -5.7560 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7430 -6.5190 -1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5780 -6.5770 0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2670 -8.7810 -0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6130 -8.0470 0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1730 -9.3290 -2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8590 -10.1530 -1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2040 -9.4190 -0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 13 2 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 M END