PUBCHEM-ZINC03729123 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 -0.9710 1.7210 -0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4560 0.3150 -0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -0.1390 0.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 -1.4380 0.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5660 -2.3140 -0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -1.8650 -1.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 -0.5440 -1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 -2.7620 -2.6070 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4120 -3.6970 -2.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5760 -3.1510 -2.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4510 -2.3330 -3.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7710 -2.7290 -3.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2460 -3.9400 -3.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4020 -4.7620 -2.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0780 -4.3640 -2.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7360 -5.9650 -2.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0830 -6.3990 -2.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0860 -1.8280 -3.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7790 -1.2420 -4.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 -2.5160 -6.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 -3.1490 -5.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 -3.7010 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1890 2.3800 -0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8430 1.7730 -1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 2.0900 0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 0.5140 1.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 -1.7620 1.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9860 -0.1630 -2.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1320 -1.3790 -4.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4370 -2.0870 -4.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2780 -4.2080 -3.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 -5.0230 -1.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1870 -7.3580 -1.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7810 -5.6940 -1.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3230 -6.5620 -3.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5870 -2.7380 -3.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0750 -1.0790 -2.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 -0.2790 -4.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8270 -1.0300 -4.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3710 -3.2280 -7.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 -1.6390 -6.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 -3.3370 -5.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 -4.0850 -4.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3550 -4.4520 -0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9590 -3.8580 -0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 -3.8620 1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6420 -2.1990 -3.8270 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1710 -1.3340 -4.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7340 -2.1200 -5.9090 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3080 -2.9490 -5.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 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 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 47 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 18 47 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 49 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 47 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 47 48 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 47 1 M END