IBS-ZINC05149927 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 55 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 -2.5850 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4780 -2.8150 -1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7700 -3.2920 -1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3910 -3.5320 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7470 -4.0350 0.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0240 -4.1490 1.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2930 -4.6210 2.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1760 -4.9380 1.1390 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.8750 -4.8140 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7060 -4.3800 -0.5460 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.6150 -4.7530 3.4190 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.9390 -5.2450 3.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0330 -5.2950 5.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4900 -4.1960 6.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5590 -4.2860 7.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1730 -5.4610 8.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7430 -6.4860 7.3150 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.6690 -6.4380 6.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6470 -3.6500 2.6540 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.6740 -3.2780 1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4190 -2.8200 1.1620 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2800 -3.4670 -2.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0160 -3.4580 -3.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0220 -2.6340 -2.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.4250 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6170 -5.0810 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9640 -4.5200 4.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7050 -4.5750 3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0900 -6.2450 3.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7840 -3.2900 5.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9100 -3.4500 7.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2240 -5.5400 9.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3170 -7.2990 5.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8040 -4.4180 -2.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9390 -2.6420 -2.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6450 -4.4700 -3.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2150 -2.9650 -4.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0670 -1.5820 -2.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0100 -3.0170 -2.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 25 2 0 0 0 0 6 7 2 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 24 2 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 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 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 44 1 0 0 0 0 21 22 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 M END