CHEMBRIDGE-ZINC04543239 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 -0.1330 1.8230 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 0.4060 -0.0810 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 -0.2800 0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4480 0.3070 0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5860 -0.4750 0.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5530 -1.8500 0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 -2.4520 0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 -1.6740 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -2.2920 -0.4730 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 -2.2510 0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 -3.6710 0.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 -4.3430 -0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6160 -5.6710 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1470 -6.3400 1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 -5.6850 2.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 -4.3570 1.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3400 -3.9040 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3550 -4.6760 0.1720 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0240 -5.9980 -0.1430 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9950 -6.8260 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2340 -6.5110 0.4920 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1590 -7.5090 0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3000 -7.3230 1.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5980 -8.8580 0.2080 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6030 -9.5070 1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8570 -8.5240 -0.2640 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.3960 -9.4260 -0.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0010 -10.8590 -1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7100 -11.5890 -0.3020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 2.2040 -0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8650 2.2600 -0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 2.1290 1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5270 1.3750 0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5060 -0.0070 1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4530 -2.4370 0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8190 -1.6840 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -1.7600 1.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6110 -3.8370 -1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2640 -6.1840 -0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4290 -7.3750 1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 -6.2130 2.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 -3.8660 2.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4050 -4.3310 -0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4400 -5.5490 0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4640 -9.4480 -0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3100 -8.7860 -1.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0350 -11.1380 -2.5190 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 26 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 29 2 0 0 0 0 28 47 1 0 0 0 0 M CHG 1 47 -1 M END