IBS-ZINC02092271 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 3.0450 0.2230 -1.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 0.5920 -0.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.5480 -1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 -1.4770 -0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 -2.5350 -0.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6290 -3.3610 0.3530 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0650 -2.6550 -1.6940 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 -1.7660 -2.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.6820 -2.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 0.2440 -3.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 0.0960 -4.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3450 -0.9720 -4.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 -1.9040 -3.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0030 -1.1050 -6.0860 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3300 -0.8990 -6.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8700 -0.5090 -5.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1470 -1.1560 -7.3110 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7910 -0.5170 -8.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0050 -2.6230 -7.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5560 -0.8590 -7.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5100 -0.2090 -8.2260 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.8090 -0.0740 -7.6670 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7820 0.8810 -8.7730 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6420 -1.4130 -9.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6640 -2.3420 -9.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7680 -3.2860 -10.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8480 -3.3000 -11.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8260 -2.3700 -11.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7250 -1.4240 -10.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9600 -4.3300 -12.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4080 -0.6690 -1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9780 0.0270 -2.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7360 1.0480 -1.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7300 0.7890 0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2990 1.4840 -1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9710 -1.4060 0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 1.0740 -3.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3200 0.8120 -5.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2230 -2.7290 -4.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3610 -3.2620 -6.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5960 -2.8080 -8.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9570 -2.8440 -7.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9290 -1.0440 -6.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3820 -2.3310 -8.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5660 -4.0130 -10.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1080 -2.3820 -12.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9290 -0.6950 -10.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5840 -3.9400 -13.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9680 -4.5580 -12.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4110 -5.2390 -12.2090 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 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 2 0 0 0 0 3 9 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 7 1 0 0 0 0 7 8 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 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 29 47 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 M END