IFLAB-ZINC04138619 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 0 0 0 0 0 0999 V2000 -0.0990 1.3880 0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.1380 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 -0.5360 -1.1840 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 -0.6440 -1.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2240 -1.0280 -2.6210 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0890 -1.1640 -3.2090 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 -0.8820 -2.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6120 -0.9350 -2.7350 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.5580 -1.4650 -4.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9630 -1.5830 -4.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9070 -1.3330 -4.2790 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1890 -2.0010 -6.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4910 -2.1110 -6.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6940 -2.5040 -8.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6140 -2.7880 -9.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3230 -2.6820 -8.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1020 -2.2840 -7.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0960 -0.3800 -0.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1250 -0.8220 0.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2580 -0.3740 1.5220 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.5600 2.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0080 0.3810 0.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3230 0.4090 -0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8590 1.1030 -1.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0630 1.7570 -1.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7420 1.7280 -0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2210 1.0530 0.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9040 1.8140 0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 1.7530 -0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6120 1.6840 1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5510 -0.5030 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0090 -0.5640 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0070 -0.7320 -5.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0620 -2.4330 -4.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3350 -1.8900 -6.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6990 -2.5890 -8.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7800 -3.0960 -10.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4850 -2.9060 -9.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0940 -2.1970 -6.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -1.4340 1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3330 1.1270 -2.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4810 2.2950 -2.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6860 2.2450 -0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7590 1.0350 1.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 M END