IBS-ZINC02094029 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 73 0 0 1 0 0 0 0 0999 V2000 2.7480 -1.6650 -3.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0130 -2.5940 -2.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1180 -2.4290 -1.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 -3.2820 -0.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 -4.3000 -1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5570 -4.4650 -2.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -3.6090 -3.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 -5.3880 -0.1220 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3540 -6.6140 -0.8230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 -5.2920 1.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7170 -4.7700 0.0880 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6440 -4.7020 -1.0440 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0780 -4.6900 -1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4830 -3.4280 -0.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5840 -2.2240 -1.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0250 -1.5530 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 -0.5170 -0.5060 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 0.1080 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 -0.4940 -1.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1480 -1.5660 -2.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 -1.7940 -3.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8140 -0.9770 -4.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0020 0.0790 -4.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7610 0.3270 -2.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5510 -5.9050 -1.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4360 -6.7340 -0.1520 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4880 -6.0560 -1.9740 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3300 -7.1140 -1.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5770 -6.9380 -1.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4340 -7.9910 -1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0580 -9.2570 -1.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9590 -10.4060 -1.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5410 -11.6090 -1.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2620 -11.7200 -2.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8950 -12.8040 -2.9280 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4430 -10.6640 -2.6310 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8000 -9.4410 -2.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9430 -8.3580 -2.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5950 -8.5370 -2.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6120 -12.6540 -1.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9040 -11.8530 -1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3470 -10.5210 -0.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7680 -2.0230 -3.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2370 -1.6350 -4.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7710 -0.6640 -3.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7280 -1.6340 -1.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -3.1540 0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 -5.2600 -2.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 -3.7360 -4.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9960 -4.4530 0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2140 -3.4070 -1.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0020 -3.4110 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1510 -1.7960 1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0150 -2.6140 -3.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 -1.1540 -5.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 0.7170 -4.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1260 1.1510 -2.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8670 -5.9610 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4000 -7.8490 -0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8580 -8.7980 -2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6510 -9.3340 -3.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3010 -7.6070 -3.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7310 -13.2750 -2.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3600 -13.2690 -0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4620 -11.6900 -2.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5230 -12.3530 -0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2970 -10.5530 0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9670 -9.6870 -1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 46 1 0 0 0 0 4 5 1 0 0 0 0 4 47 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 48 1 0 0 0 0 7 49 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 50 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 25 1 0 0 0 0 14 15 1 0 0 0 0 14 51 1 0 0 0 0 14 52 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 54 1 0 0 0 0 22 23 2 0 0 0 0 22 55 1 0 0 0 0 23 24 1 0 0 0 0 23 56 1 0 0 0 0 24 57 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 38 2 0 0 0 0 29 30 2 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 30 59 1 0 0 0 0 31 32 1 0 0 0 0 31 37 2 0 0 0 0 32 33 2 0 0 0 0 32 42 1 0 0 0 0 33 34 1 0 0 0 0 33 40 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 60 1 0 0 0 0 39 61 1 0 0 0 0 39 62 1 0 0 0 0 40 41 1 0 0 0 0 40 63 1 0 0 0 0 40 64 1 0 0 0 0 41 42 1 0 0 0 0 41 65 1 0 0 0 0 41 66 1 0 0 0 0 42 67 1 0 0 0 0 42 68 1 0 0 0 0 M END