IBS-ZINC05141854 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 -0.9710 -3.0720 4.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 -4.2160 3.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3210 -5.1680 4.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0530 -3.6200 2.5250 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0390 -4.2480 1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6410 -3.5180 0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7000 -4.0300 -1.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1430 -5.2800 -1.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5600 -6.0280 -0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5090 -5.5090 1.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1990 -5.7870 -2.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1920 -5.5920 -3.3580 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 -6.4200 -3.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -7.5220 -3.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 -7.7460 -4.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -8.6590 -5.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 -6.7330 -3.9290 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 -5.8170 -3.0980 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7400 -5.9360 -2.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4830 -4.3740 -3.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 -3.4590 -2.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -2.1240 -3.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 -1.6850 -4.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -2.5800 -5.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 -3.9160 -4.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 -6.6010 -4.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8530 -5.9950 -5.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5670 -5.7440 -7.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1270 -5.0310 -5.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0680 -8.3230 -4.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4480 -3.4450 5.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 -2.3740 4.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 -2.4950 4.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 -4.7260 3.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2360 -4.6520 4.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6330 -5.9930 3.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8420 -5.5930 5.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0690 -2.5410 0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1710 -3.4480 -1.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1610 -7.0220 -0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0610 -6.1250 1.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6350 -3.7730 -1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8590 -1.4230 -2.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 -0.6440 -4.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 -2.2350 -6.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 -4.5900 -5.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0040 -6.0110 -3.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9990 -7.6070 -4.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3590 -6.5890 -6.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5030 -4.9610 -5.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1830 -4.7510 -7.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0450 -6.5210 -7.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6420 -5.8090 -7.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0500 -5.3380 -3.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7240 -4.0250 -5.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1720 -5.0820 -5.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7100 -9.0210 -4.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3360 -5.9960 -5.8800 N 0 3 0 0 0 0 0 0 0 0 0 0 4.6960 -6.9420 -5.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 13 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 30 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 58 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 58 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 29 58 1 0 0 0 0 30 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END