IFLAB-ZINC04194684 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 -0.0210 1.5270 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.0030 -0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4350 -0.5320 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 -2.0620 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8490 -2.5920 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8300 -4.0210 -0.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0300 -4.6530 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0810 -6.0420 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2970 -6.6880 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4810 -5.9450 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4250 -4.5490 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2050 -3.9110 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7860 -6.6330 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8330 -7.8480 0.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9260 -5.9140 0.0550 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.1580 -6.5600 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2480 -7.8020 -0.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4690 -8.4400 -0.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6110 -7.8470 -0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5400 -6.6130 0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3120 -5.9600 0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2280 -4.6410 1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2220 -4.0380 1.7450 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.7810 -2.8500 2.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3890 -1.8150 2.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6530 -0.7080 3.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3120 -0.6150 2.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6980 -1.6300 2.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4230 -2.7520 1.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1160 -3.8840 1.2160 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 1.9050 -0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 1.8810 -0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 1.8860 0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 -0.3620 -0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5310 -0.3560 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9410 -0.1730 0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9660 -0.1790 -0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9080 -2.4210 -0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8830 -2.4160 0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3550 -2.2330 0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3800 -2.2380 -0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1660 -6.6160 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3370 -7.7670 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3370 -3.9710 0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1600 -2.8320 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8900 -4.9480 0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3620 -8.2710 -1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5340 -9.4070 -1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5620 -8.3540 -0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4340 -6.1540 0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4330 -1.8820 3.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1220 0.0930 3.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7440 0.2580 3.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6540 -1.5500 1.9930 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 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 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 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 43 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 19 20 2 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 30 1 0 0 0 0 23 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 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 M END