PUBCHEM-ZINC05824947 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 0.0420 1.9850 -0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 0.4940 -0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 -0.2180 -1.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 -1.7170 -1.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4820 -2.4290 -2.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6510 -3.9270 -2.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1440 -4.6270 -3.7850 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5230 -4.6820 -3.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8040 -5.3400 -5.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6240 -5.7120 -5.6560 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5150 -6.2170 -6.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 -5.2700 -4.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 -5.4760 -5.1790 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0640 -6.0510 -6.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5150 -6.4680 -6.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2690 -5.4520 -4.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8460 -5.0180 -4.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0600 -5.5790 -5.5430 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1740 -5.1220 -4.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3380 -5.2970 -5.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8910 -4.4230 -3.6780 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6940 -4.0790 -3.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6440 -4.1390 -3.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5050 -3.4820 -2.1290 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2480 -6.3120 -6.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 2.4530 -1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 2.1720 -1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 2.4740 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 0.3420 0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7590 0.0630 -0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 -0.0600 -2.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7290 0.2200 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6080 -1.8750 -0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -2.1550 -1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 -2.2720 -3.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4440 -1.9860 -3.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2990 -4.1280 -1.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 -4.3620 -2.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -5.2890 -7.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5630 -6.9350 -6.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7510 -6.5160 -7.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7280 -7.4430 -6.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4830 -6.4610 -4.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0170 -4.7650 -4.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 -5.4230 -3.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 -3.9250 -4.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7560 -5.7700 -7.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3060 -6.4270 -7.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8030 -7.3070 -6.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4440 -5.4850 -6.1310 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.4170 -5.7480 -6.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3170 -4.5450 -6.5370 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 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 2 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 50 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 16 50 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 25 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 50 51 1 0 0 0 0 50 52 1 0 0 0 0 M CHG 1 13 1 M CHG 1 50 1 M END