IFLAB-ZINC04159862 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 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 0 0 0 0 0 0 0 0 0 0 0.6770 -0.4970 1.2000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 -1.6830 1.4720 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1940 -2.4570 0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 -2.2750 2.8540 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2450 -1.4900 3.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -2.9320 2.7580 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3100 -2.2740 1.7280 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2640 -1.9420 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 -1.1010 1.2730 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6260 -0.3010 2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 -0.5170 0.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5300 -3.1830 0.6000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0370 -4.4580 0.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2400 -5.2960 -0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9630 -4.8330 -1.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1590 -5.5700 -2.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4330 -3.5690 -1.5260 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9290 -3.2450 -2.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2200 -2.7570 -0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6540 -1.6210 -0.4960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 -3.2910 3.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -3.7450 4.5100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.5060 -1.2460 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 -1.4870 -4.7930 1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8560 -6.3040 -0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 -4.1390 2.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 -2.8200 3.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 -4.3930 4.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7500 -0.1210 -1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -1.5950 -1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 -0.1580 -2.1370 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 13 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 23 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 14 15 1 0 0 0 0 14 21 1 0 0 0 0 15 16 2 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 30 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 19 21 1 0 0 0 0 21 22 2 0 0 0 0 23 24 1 0 0 0 0 23 31 1 0 0 0 0 23 32 1 0 0 0 0 24 33 1 0 0 0 0 25 34 1 0 0 0 0 25 35 1 0 0 0 0 25 36 1 0 0 0 0 M END