IBS-ZINC05197864 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -2.5210 0.5720 3.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9520 -0.8120 3.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6590 -1.1170 2.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5720 -2.4970 2.9600 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 -3.3460 2.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2630 -4.6860 2.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 -5.2130 3.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9960 -4.3670 3.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 -2.9790 3.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5950 -1.9470 3.6020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 -0.1960 2.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4300 -0.5990 2.2130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 1.2440 2.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 1.9350 3.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 3.3560 3.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 4.2320 4.6000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3590 3.5390 2.4710 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2790 2.2390 1.7940 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2560 1.9650 1.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 2.2910 0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4360 1.7640 -0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3690 1.8100 -1.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6070 2.3840 -1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9120 2.9130 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9740 2.8710 0.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1210 3.4740 0.1060 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.7410 4.8110 1.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 5.5060 1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 7.5850 0.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7040 6.5600 -0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 1.4070 5.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8710 0.9440 2.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3550 0.5370 4.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7490 1.2360 3.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3990 -2.9480 2.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -5.3510 2.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 -6.2820 3.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9550 -4.7610 3.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 1.3140 -0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 1.3980 -2.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3360 2.4200 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2090 3.2870 1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 4.6240 1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2140 5.4500 2.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 5.6930 2.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9810 4.8670 0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 7.0340 -0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8690 7.7940 1.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 8.5240 -0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6100 6.0230 -0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 5.9720 -1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9730 7.5200 -0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 2.0520 5.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 6.7820 0.6840 N 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 10 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 11 12 2 0 0 0 0 11 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 14 31 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 27 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 42 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 28 54 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 54 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 54 1 0 0 0 0 31 53 1 0 0 0 0 M END