CHEMDIV-ZINC06748767 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 55 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 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 -2.5340 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0270 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -0.0120 -2.4440 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 0.1320 -3.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 -0.1410 -3.6780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 0.6210 -4.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 0.9370 -4.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0740 1.3920 -5.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 1.5510 -7.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 1.2330 -7.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 0.7790 -6.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 1.5430 -8.7920 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 2.0780 -9.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9630 2.0010 -8.2730 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2090 2.4240 -8.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0760 2.7350 -10.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 2.5140 -10.3880 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1530 3.2320 -10.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8800 3.5150 -12.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8860 3.9760 -13.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1640 4.1580 -12.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4400 3.8790 -11.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4440 3.4110 -10.4290 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 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 -2.4020 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -2.4180 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5020 -2.1570 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 -3.6240 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -2.3790 -2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -2.4050 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9340 0.2050 -2.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 0.8220 -3.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1250 1.6300 -5.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6820 0.5440 -6.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1130 2.4920 -8.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8830 3.3740 -12.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6750 4.1960 -14.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9480 4.5190 -13.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4390 4.0230 -10.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6620 3.1890 -9.3950 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 8 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 24 2 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 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 30 51 1 0 0 0 0 M END