IBS-ZINC04090361 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 0.2230 -0.3590 -1.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8470 -1.4930 -0.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 -1.3830 -0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7170 -0.1350 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0810 0.9970 -0.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 0.8850 -1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0810 -0.0420 0.5480 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3390 -0.9900 1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0870 1.0820 1.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7200 2.1280 1.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1170 0.2300 -0.4550 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6340 -0.6750 -1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3170 -1.8580 -1.4100 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6820 -0.0460 -2.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0480 -0.9400 -3.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0130 -0.2730 -4.2670 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3730 -0.4480 -4.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9960 -1.1800 -3.4500 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0210 0.4180 -5.2780 C 0 0 3 0 0 0 0 0 0 0 0 0 10.4370 -0.2150 -6.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0250 1.4170 -4.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2810 2.5260 -5.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4740 3.2570 -5.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7130 4.3040 -6.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7590 4.6360 -7.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5610 3.9240 -7.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3040 2.8700 -6.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9940 2.1200 -6.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8570 1.0930 -5.7950 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6770 0.6450 -5.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5550 1.0160 -5.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 -0.4460 -1.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 -2.4660 -0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5720 -2.2780 0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5520 1.9750 -0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3590 1.7710 -1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4410 1.1970 -0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3050 0.9180 -2.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5690 0.1620 -1.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4780 -1.8840 -3.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1550 -1.1680 -4.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6560 1.8730 -3.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9590 0.8960 -4.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2280 3.0150 -4.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6430 4.8630 -6.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9470 5.4520 -8.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8270 4.2000 -8.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1460 2.8080 -6.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9490 1.6180 -7.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5060 0.8210 2.7180 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 9 10 2 0 0 0 0 9 50 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 14 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 15 41 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 19 29 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 M CHG 1 50 -1 M END