IFLAB-ZINC04392559 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.0070 1.5250 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 0.0180 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -0.7040 1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -2.4110 0.6830 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -1.9650 -1.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -0.6660 -1.1210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.9120 -2.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -2.4350 -3.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -3.3250 -4.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -4.6870 -4.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -5.1670 -2.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -4.2880 -1.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.1550 2.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 0.0190 3.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 0.5540 4.3780 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5700 0.7890 5.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6240 0.5590 4.4580 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5640 1.3340 6.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 1.5640 6.9620 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7280 1.5700 7.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7230 1.9880 8.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7170 2.8260 8.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7140 3.2380 10.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7130 2.8150 11.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7170 1.9800 10.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7280 1.5700 9.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7070 3.3340 12.6730 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 1.8980 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 1.8940 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5170 1.8740 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -1.3720 -3.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -2.9570 -5.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -5.3800 -5.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -6.2320 -2.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -4.6630 -0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 -0.8460 3.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 0.8110 2.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9370 0.7110 2.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9180 -0.9460 3.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 0.7380 4.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5700 1.4500 6.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 3.1560 8.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9320 3.8900 10.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4950 1.6510 11.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5130 0.9210 8.8810 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 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 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 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 41 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 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 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 44 1 0 0 0 0 26 45 1 0 0 0 0 M END