IFLAB-ZINC04159861 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 0.6650 -0.4960 1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 -0.7330 2.1710 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1980 -0.1340 3.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 -2.2410 2.4740 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4400 -2.4020 3.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6170 -2.7470 1.8740 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5580 -1.6540 1.8370 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0120 -1.5070 2.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6930 -0.4140 1.4550 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1300 0.5420 1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3450 -0.5190 0.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5890 -1.8990 0.8260 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5690 -3.0610 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5200 -3.2860 -0.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5220 -2.3100 -1.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3910 -2.4910 -1.8740 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5080 -1.1770 -0.3070 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1910 -0.5030 -0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5510 -0.9800 0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5530 0.0440 1.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 -2.9460 1.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 -4.3220 2.2570 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 -0.5130 -1.2540 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 -2.7960 -3.7940 0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5150 -4.2000 -1.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7690 -2.8710 0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 -2.4720 2.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5430 -4.8320 1.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7330 -0.1320 -1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -1.6030 -1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -0.1680 -2.1390 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