IFLAB-ZINC04280085 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 1 0 0 0 0 0999 V2000 0.2520 1.3750 0.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 -0.0060 0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 -0.6800 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1390 0.0370 -0.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1150 1.4180 -0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 2.0860 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0990 2.1830 -1.5390 N 0 3 0 0 0 0 0 0 0 0 0 0 3.9290 1.5950 -2.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0780 3.4010 -1.5260 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2370 -2.0790 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -2.7720 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 -2.1860 0.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -4.2750 0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3100 -4.8100 0.3070 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8140 -4.3260 1.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2730 -6.2990 0.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8000 -7.0450 -0.2550 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4870 -4.4590 -0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2110 -4.1590 -2.0070 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8050 -3.2580 -2.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7280 -4.0010 -1.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3790 -4.6470 -3.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1780 -5.1180 -3.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0960 -5.2800 -2.9120 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 1.9000 1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 -0.5620 1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8750 -0.4840 -1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1660 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 -2.5500 -0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -4.6920 -0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 -4.5650 1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7000 -3.6690 0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8320 -5.4140 -0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0250 -4.5310 -0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9960 -2.9470 -1.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9980 -5.4950 -2.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9690 -3.9120 -3.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4060 -6.0690 -4.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9210 -4.3650 -4.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 -6.7960 1.6180 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0390 -4.5230 -0.9350 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7060 -3.6720 -1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 -7.7580 1.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 41 1 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 24 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 40 43 1 0 0 0 0 41 42 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M END