IBS-ZINC05347615 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 54 0 0 1 0 0 0 0 0999 V2000 1.1250 -2.0330 2.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 -1.6080 1.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 -2.1760 1.5060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -1.8960 0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0040 -1.1890 -0.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7980 -2.4260 0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9470 -3.7240 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1490 -4.2860 -0.2720 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2160 -3.5050 -0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1990 -2.1680 -0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3320 -1.3960 -0.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6350 -0.1150 -0.4610 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.8690 0.1030 -0.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3820 -1.0310 -1.3590 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4130 -2.0230 -1.1600 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3630 -3.3540 -1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3040 -4.0570 -1.1140 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.5570 1.4180 -0.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8530 1.5430 -1.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4560 2.7840 -1.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8260 3.8430 -0.9740 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.6020 3.7680 -0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9280 2.5640 -0.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9920 -1.5230 0.3470 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7920 -0.5740 -0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2560 -1.2740 1.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2220 0.0150 2.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4640 0.2430 3.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7410 -0.8170 4.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7770 -2.1060 3.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5390 -2.3340 2.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7160 -4.5840 -0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1220 -1.6000 3.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -1.6810 3.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 -3.1200 2.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4290 -0.5210 1.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 -1.9590 0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2160 -3.8420 -1.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3760 0.6800 -1.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4580 2.8900 -1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1220 4.6600 -0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9280 2.5100 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0050 0.8430 1.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4360 1.2500 4.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9300 -0.6390 5.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9930 -2.9340 4.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5700 -3.3400 2.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4240 -4.9530 0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9310 -5.4290 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 -3.9940 -0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 24 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 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 38 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 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 43 1 0 0 0 0 28 29 1 0 0 0 0 28 44 1 0 0 0 0 29 30 2 0 0 0 0 29 45 1 0 0 0 0 30 31 1 0 0 0 0 30 46 1 0 0 0 0 31 47 1 0 0 0 0 32 48 1 0 0 0 0 32 49 1 0 0 0 0 32 50 1 0 0 0 0 M END