IBS-ZINC06754851 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 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 0.7430 -0.5120 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 -2.0090 1.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 -2.6270 0.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 -4.3450 1.0360 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 -4.2190 2.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -2.9230 2.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 -2.5020 3.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 -2.1590 4.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6510 -2.4940 2.4900 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 -5.2840 2.7730 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 -6.5250 2.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 -6.7120 1.8880 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4590 -7.5600 3.2850 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6050 -7.3360 4.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 -7.0290 5.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 -8.1760 6.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 -8.9100 3.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6100 -9.5990 1.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7540 -10.3390 2.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3940 -10.9710 1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8900 -10.8620 -0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7450 -10.1220 -0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1030 -9.4940 0.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 -1.9050 -0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 -0.5000 0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -0.4980 -1.2570 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 1.8110 -0.3190 1.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -0.0090 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7990 -2.7670 1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4000 -2.2150 3.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1670 -5.1350 3.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2280 -8.2300 4.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1900 -6.4940 3.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9530 -6.7750 6.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 -6.1890 5.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 -8.0530 7.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0700 -9.4790 4.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 -8.8470 2.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1480 -10.4240 3.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2880 -11.5490 1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3900 -11.3550 -0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3520 -10.0370 -1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 -8.9190 0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 -2.1110 -1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4600 -2.2400 -0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 -0.1210 -1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -1.5880 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 -0.1370 -2.1400 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 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 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 19 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 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 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 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 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 M END