CHEMDIV-ZINC06900274 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 0 0 0 0 0 0999 V2000 2.4440 0.9200 0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5490 -0.2650 0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 -0.8830 1.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -1.9680 1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 -2.4190 -0.1600 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6510 -1.7550 -1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 -0.6940 -0.8570 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 -2.2760 -2.8010 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 -3.7880 -2.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9760 -0.4580 2.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 -0.2010 3.3340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 -0.3690 3.5680 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2270 0.0490 4.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 -1.1010 5.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 -0.6080 7.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -1.3420 9.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3450 -2.5430 10.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6220 -3.2320 10.4840 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9590 -3.6050 9.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 -2.3980 8.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 -3.5710 11.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8360 -3.5500 11.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6570 -3.8940 12.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1040 -4.2730 13.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7190 -4.3030 13.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9040 -3.9540 12.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0120 -4.5850 14.7270 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4920 -4.9750 15.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3510 0.6200 1.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7500 1.3520 -0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9250 1.7020 1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4580 -2.5460 1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -4.5090 -1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 -3.5650 -2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 -4.2430 -3.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0970 -0.5730 3.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 0.8780 5.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2330 0.4260 5.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 -1.8860 5.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0730 -1.5470 5.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 0.1000 7.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 -0.1300 7.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8000 -0.9240 9.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 -0.5630 9.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -2.1600 11.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 -3.2500 10.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9600 -4.0370 9.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 -4.3860 8.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5740 -1.6220 8.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9680 -2.7250 7.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3230 -3.2340 10.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7370 -3.8590 12.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2340 -4.5980 14.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8270 -4.0210 12.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3400 -5.1860 16.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9100 -4.1670 16.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8990 -5.8920 15.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -1.7650 8.2940 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.2400 -2.4930 8.0780 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 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 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 58 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 16 58 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 20 58 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END