IFLAB-ZINC04337611 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 42 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7460 -0.4900 1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 0.1110 2.3910 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2230 0.0860 2.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7970 0.3660 3.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1420 0.3680 3.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9880 0.0840 2.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3860 0.0770 2.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1710 -0.2040 1.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6090 -0.4860 0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2600 -0.4870 0.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4170 -0.2010 1.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0170 -0.1950 1.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4310 -0.5100 0.0560 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0160 0.0000 -0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5290 -1.9900 -0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 -2.8230 -0.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 -4.1360 -0.7690 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3970 -4.8120 -1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2320 -4.4570 -0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7430 -5.5630 -0.3770 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9500 -2.9890 0.1710 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 -2.2480 -1.1730 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7060 -0.4750 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 -1.5750 1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7920 -0.1910 1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1530 0.5850 4.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5620 0.5860 4.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8340 0.2940 3.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2450 -0.2100 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2550 -0.7060 -0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8390 -0.7060 -0.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -0.2470 -2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 0.0290 -1.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 15 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 14 2 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 24 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 24 25 1 0 0 0 0 25 37 1 0 0 0 0 25 38 1 0 0 0 0 M END