IFLAB-ZINC04339644 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -1.9180 1.6500 -0.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 0.1450 -0.6250 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4600 -0.1050 -1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 -0.2470 0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 -1.7560 0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 -2.5110 0.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9120 -0.6270 -0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8900 -2.9230 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8020 -4.3730 -0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2590 -5.3900 0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2210 -6.7510 0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7280 -7.1370 -1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2900 -6.1370 -1.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3240 -4.7880 -1.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8270 -3.9630 -2.5580 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4560 -4.8040 -3.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9280 -4.4260 -4.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6330 -3.0380 -5.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 -2.2230 -4.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 -0.9130 -4.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9910 -0.4080 -5.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7260 -1.2120 -6.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0430 -2.5320 -6.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7510 -3.3930 -7.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0340 -2.9710 -8.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7330 -6.2120 -3.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5380 -7.2140 -3.9310 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7530 -5.0290 1.7410 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 2.2080 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7670 1.9360 -1.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1370 1.9640 0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4480 0.2550 -0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5850 0.0900 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -2.0740 -0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -2.0110 0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3220 -3.5890 0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7550 -2.2820 1.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2030 -0.3920 0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7530 -0.4210 -0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7030 -2.4710 -0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1080 -2.7720 1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5780 -7.5210 0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6930 -8.1800 -1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7120 -5.1730 -5.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 -2.6110 -3.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -0.2910 -3.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7460 0.6130 -6.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0350 -0.7780 -7.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5240 -3.8030 -9.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7270 -2.1240 -8.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1150 -2.7350 -9.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0530 -5.8250 2.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6350 -2.1120 -0.2500 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.3810 -2.3270 -1.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 6 53 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 7 53 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 8 53 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 12 13 2 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 26 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 2 0 0 0 0 28 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END