IBS-ZINC02150756 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2950 -0.6030 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1540 -2.1260 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5430 -2.7680 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4080 -4.2260 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5070 -5.0050 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6090 -4.4990 0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3680 -6.5060 -0.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8220 -6.8280 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6430 -6.9830 1.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8310 -7.2980 2.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9800 -7.5880 1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0110 -8.1450 1.5870 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6910 -7.1390 0.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5820 -7.2660 -1.1190 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.5190 -6.7430 -0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8500 -8.7210 -1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4270 -9.7370 -0.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5360 -11.0040 -1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0660 -11.2510 -2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4850 -10.2390 -3.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3730 -8.9590 -2.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8160 -7.6980 -3.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3180 -7.5600 -4.3200 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9390 -6.7220 -2.3040 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8320 -0.2940 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8490 -0.2840 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 -2.4360 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 -2.4450 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0800 -2.4580 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0970 -2.4490 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5260 -4.6320 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0540 -7.8790 1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0190 -6.1910 1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6110 -8.1720 2.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0600 -6.4370 2.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7950 -9.5480 0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9880 -11.8010 -0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1530 -12.2410 -2.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1190 -10.4360 -4.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 26 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 M END