IFLAB-ZINC04337074 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 1 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 1.0910 2.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 3.0240 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 3.4550 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8700 4.9150 0.0710 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6410 5.5250 -0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2350 4.8650 -1.6780 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7650 7.0140 -0.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1720 7.6750 -0.0270 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5370 7.6240 -1.7760 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6580 9.0840 -1.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5840 9.5160 -2.9180 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.6680 10.6030 -2.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9160 8.9180 -2.7290 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1760 8.1040 -3.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2100 8.7210 -4.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0580 9.0540 -4.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9200 9.1160 -1.4270 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.7800 7.9850 -1.4080 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0900 9.4800 -0.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9410 10.5120 -1.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1510 10.3440 -2.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9520 11.4380 -2.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5440 12.7030 -2.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3330 12.8710 -1.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5350 11.7750 -1.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5490 14.0790 -2.6230 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 1.5250 2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 0.0040 2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 1.3960 3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 3.4700 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 3.3560 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 3.1230 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7330 3.0090 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3960 5.4430 0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0110 7.0970 -2.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0730 9.4160 -0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6740 9.5310 -1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9320 7.0570 -3.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2120 8.2110 -4.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9490 7.9900 -5.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6430 9.6150 -5.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4700 9.3560 -2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8970 11.3060 -3.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0130 13.8580 -1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5910 11.9060 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5600 1.2170 N 0 0 0 0 0 0 0 0 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 1 50 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 50 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 50 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 M END