PUBCHEM-ZINC00000460 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 1 0 0 0 0 0999 V2000 -0.0300 2.0190 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 0.5080 0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 -0.2010 0.2540 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2000 -1.7330 0.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 -2.4980 -0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 -2.3800 -1.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -1.9340 -2.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2250 0.0060 -1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3670 0.1130 -3.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3650 -0.3330 -3.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8260 -0.1430 -4.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4170 1.2000 -3.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1030 0.3650 1.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4530 0.3870 2.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0780 0.8870 3.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3760 1.3770 3.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0370 1.3560 2.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4200 0.8580 1.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3150 1.8210 2.5030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 2.4240 -0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 2.2740 -1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 2.5300 0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 0.0900 -0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6470 0.3110 0.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 -1.9200 1.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1720 -2.2260 0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8580 -2.2370 0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 -3.5610 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6990 -1.7210 -2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 -3.3660 -2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 -2.1510 -3.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3060 -2.4320 -2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1790 -0.5330 -0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4560 1.0710 -1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 0.0050 2.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5450 0.8880 4.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8500 1.7620 4.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0150 0.8770 0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6190 2.1350 3.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5860 -0.4360 -2.3310 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.6610 0.0050 -2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 7 40 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 9 40 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 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 38 1 0 0 0 0 19 39 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 40 1 M END