IBS-ZINC02295225 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 0 0 0 0 0999 V2000 0.0550 1.6600 -0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 0.1600 -0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8940 -0.3800 0.6460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 -0.5780 -1.1050 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 -1.9120 -1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 -2.7330 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 -4.0870 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -4.6350 -1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 -3.8030 -2.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6510 -2.4520 -2.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 -6.0780 -1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -6.8220 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4710 -8.2850 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -8.8360 -1.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 -9.0170 1.0310 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 -10.4640 0.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3430 -11.0410 2.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 -11.4800 2.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 -12.0090 4.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 -12.1000 4.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -11.6630 4.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 -11.1370 3.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -6.1960 1.1620 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1580 -6.5490 1.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 -7.4730 1.3520 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 -5.8110 2.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7910 -6.1730 3.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2030 -5.4810 4.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4450 -4.4300 5.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2700 -4.0660 4.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8440 -4.7530 3.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 2.0990 -0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 1.9300 -0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 2.0350 0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4230 -2.3090 0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 -4.7240 0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 -4.2200 -2.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 -1.8090 -2.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 -6.5460 -2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -8.5860 1.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 -10.9230 0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5810 -10.6650 0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7390 -11.4090 2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 -12.3510 4.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 -12.5130 5.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 -11.7340 5.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 -10.7990 2.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 -5.5090 1.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3830 -6.9930 3.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1190 -5.7600 5.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7720 -3.8920 6.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6840 -3.2440 4.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -4.4710 2.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 23 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 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 2 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 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 29 30 2 0 0 0 0 29 51 1 0 0 0 0 30 31 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 M END