IFLAB-ZINC00645023 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 59 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 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1100 -0.6540 -1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7730 -2.0030 -1.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 -0.9230 1.4460 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.1200 -1.8510 1.1270 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0390 -1.2110 2.3560 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8980 0.5200 2.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2150 0.7730 1.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8680 1.8970 2.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1960 2.7790 3.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8170 4.0020 3.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1900 4.2150 3.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7380 5.3650 3.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9270 6.3070 4.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5640 6.1090 4.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9930 4.9580 4.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6520 4.7720 4.2320 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1930 3.5000 4.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 3.1730 4.9680 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8530 2.5220 3.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2140 1.3840 2.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6410 7.7710 5.2750 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.6050 8.7420 5.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8680 7.9710 4.5860 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0370 7.4450 6.8500 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0630 7.6920 7.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3100 9.0750 8.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3600 6.9100 7.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2870 5.3840 7.2620 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 -3.1800 -0.6040 -1.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8280 0.1500 -1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3220 -2.1100 -2.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 -2.0540 -2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0540 -2.8070 -1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7350 0.0840 1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8930 2.0870 1.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8230 3.4810 2.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8030 5.5330 3.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9410 6.8490 5.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 1.1790 3.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1700 6.9320 8.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0540 7.6520 7.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5850 9.2590 9.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2030 9.8360 7.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3180 9.1160 8.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6880 7.3120 8.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0700 7.1960 6.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9590 4.9820 6.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5770 5.0980 8.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2720 4.9860 7.5060 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 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 7 2 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 23 2 0 0 0 0 10 11 2 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 22 2 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 M END