IFLAB-ZINC04570117 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.7430 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -0.9120 1.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -1.6540 3.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 -2.2280 4.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.8240 -1.4370 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 -2.1160 -1.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 0.0550 -2.3990 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6820 -1.0600 -1.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3540 -2.2010 -1.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6620 -2.3840 -1.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2880 -1.4160 -2.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6270 -0.2830 -3.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3110 -0.1050 -2.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6370 0.4940 -3.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8920 -0.3630 -3.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9530 -0.1060 -4.3540 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6120 -1.4520 -3.1050 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4650 -2.6050 -2.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5630 -3.8240 -2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5050 -3.5700 -1.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -1.7250 1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -0.1920 2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 0.0700 1.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9950 -1.4630 1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 -2.9380 -0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7730 0.7760 -3.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2900 0.6150 -4.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8250 1.4660 -3.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1580 -2.8030 -3.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0230 -2.3920 -1.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0620 -4.0680 -3.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1790 -4.6710 -2.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9980 -3.3690 -0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8690 -4.4500 -1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 3 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 22 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 M END