IFLAB-ZINC01792052 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 0.4240 1.3920 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -0.0860 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 -0.7830 1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 -2.1360 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 -2.8120 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 -2.1050 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -0.7400 -1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 -2.8470 -2.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -2.2430 -3.6320 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -3.0280 -4.8640 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1050 -4.0900 -4.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 -2.6710 -5.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5820 -3.0930 -4.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5900 -3.8980 -5.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4340 -4.0180 -4.0530 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2540 -4.5360 -4.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9130 -3.2830 -3.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8070 -2.7290 -3.4640 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0640 -2.7190 -5.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9030 -1.9240 -5.4090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4970 -4.2420 -2.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 -4.8240 -1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 -4.1370 -0.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 -6.2700 -1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0530 -7.0120 -2.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3250 -8.3630 -2.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 -8.9880 -1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 -8.2540 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2160 -6.9010 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7120 -8.8700 1.2910 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6430 -8.0560 2.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8140 -10.3200 -1.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 1.5480 0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 1.8620 -0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 1.8340 0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -0.2610 2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -2.6700 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2710 -0.1960 -2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4480 -3.1880 -6.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4490 -1.5950 -5.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7080 -4.3590 -6.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3420 -3.1700 -2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 -4.8300 -3.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8820 -6.5280 -3.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 -8.9350 -3.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1720 -6.3320 0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8360 -8.6700 3.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 -7.6120 2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3910 -7.2660 2.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0280 -10.8770 -0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 -3.3270 -6.9530 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9420 -3.0960 -7.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 21 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 19 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 19 20 2 0 0 0 0 19 51 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 28 2 0 0 0 0 27 32 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 46 1 0 0 0 0 30 31 1 0 0 0 0 31 47 1 0 0 0 0 31 48 1 0 0 0 0 31 49 1 0 0 0 0 32 50 1 0 0 0 0 51 52 1 0 0 0 0 M END