IBS-ZINC04046690 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 0 0 0 0 0999 V2000 0.6970 0.3620 -1.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -0.0140 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 0.3660 1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 0.0030 2.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 0.3500 3.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2790 -0.7160 2.4140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 -1.1260 1.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2310 -0.7940 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8100 -1.2110 -1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9660 -1.9370 -1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5730 -2.2650 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0090 -1.8680 1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6750 -2.2280 2.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7240 -2.9870 0.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8720 -2.3030 0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8590 -1.0950 0.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1780 -3.0430 0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3240 -2.0360 0.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5940 -2.7550 0.5760 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.7470 -2.0690 0.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7330 -0.8540 0.7040 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.9130 -2.7300 0.8230 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.1160 -1.9260 0.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3140 -2.8310 1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7370 -3.2510 2.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.8360 -4.0810 2.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.5130 -4.4910 1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.0900 -4.0710 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.9940 -3.2370 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 1.1750 1.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5930 0.9410 -1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9750 -0.5430 -1.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 0.9590 -1.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3430 -0.9600 -2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4120 -2.2590 -2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3850 -1.4470 2.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2020 -3.1760 2.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9200 -2.3210 3.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3370 -3.6650 -0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1490 -3.6720 1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1650 -1.4130 1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3540 -1.4070 -0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6040 -3.7250 0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0390 -1.3000 1.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2280 -1.2940 0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2080 -2.9300 3.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.1660 -4.4090 3.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.3710 -5.1410 1.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.6190 -4.3920 -0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6660 -2.9060 -1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 2.2370 1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 0.9470 2.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4180 0.9240 0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 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 2 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 M END