IBS-ZINC06670439 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 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 1.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 -2.6270 0.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4930 -4.3450 1.0350 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 -4.2200 2.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 -2.9220 2.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 -2.5020 3.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 -2.1590 4.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6500 -2.4940 2.4920 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7210 -2.0660 3.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4040 -5.2820 2.7730 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9010 -6.5240 2.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -6.7090 1.8890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5110 -7.6710 3.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4600 -7.4850 4.0910 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0080 -8.9120 3.2080 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6070 -10.0370 3.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 -11.3240 3.5850 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2120 -11.2010 3.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 -12.5100 4.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 -13.7010 3.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7710 -13.0930 2.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0790 -11.6830 2.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 -1.9050 -0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 -0.5000 0.0140 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 -0.3200 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 4.5340 -1.0440 3.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7650 -2.7250 4.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6700 -2.1070 2.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 -5.1340 3.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -9.0600 2.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6530 -10.1400 3.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5440 -9.8560 5.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4410 -12.3130 4.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -12.7040 5.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 -14.0930 3.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 -14.4830 3.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2450 -13.5370 1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 -13.2430 2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 -2.1100 -1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4610 -2.2400 -0.0500 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 0.1900 -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 13 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 12 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 25 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 M END