IBS-ZINC05093567 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 0 0 0 0 0 0999 V2000 0.0190 1.4690 0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.0450 0.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 -0.5730 0.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 -2.0870 0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7610 -2.5880 0.1680 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9300 -3.9130 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9640 -4.6300 -0.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2850 -4.4930 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4620 -5.8670 -0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7290 -6.4050 -0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8330 -5.5830 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6610 -4.2140 0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3970 -3.6700 0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1140 -6.1300 0.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3110 -7.3710 0.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3920 -7.9740 1.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6600 -8.0040 0.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5800 -7.4010 -0.0720 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.8570 -9.2450 0.9310 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.1810 -9.8660 0.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1340 -11.2410 1.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5040 -11.4130 2.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4580 -12.6830 3.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0380 -13.7370 2.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6820 -13.4880 1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7440 -12.2680 0.7240 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 1.8450 0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 1.9480 -0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 1.6920 1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 -0.2690 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 -0.5240 1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8580 -0.3500 1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9870 -0.0940 -0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9490 -2.3110 -0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 -2.5660 0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6050 -6.5060 -0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8660 -7.4670 -0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5210 -3.5780 0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2640 -2.6090 0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8640 -5.6180 -0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1230 -9.7260 1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9070 -9.2540 1.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4750 -9.9450 -0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8260 -10.5690 3.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7410 -12.8470 4.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9880 -14.7390 2.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3540 -14.3030 0.5920 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 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 17 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 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 M END