CHEMBRIDGE-ZINC00311667 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 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 0.7180 -0.4980 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2440 -0.0640 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1650 -0.0790 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6830 0.7340 -2.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0110 1.1180 -2.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8200 0.6880 -1.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3020 -0.1250 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9730 -0.5050 -0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 -2.0000 -1.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -2.7040 -2.2850 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 -3.9970 -1.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 -4.0030 -0.7790 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 -2.8660 -0.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 -5.1870 -2.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8860 -5.0280 -3.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3090 -6.1380 -4.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 -7.4060 -4.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 -7.5700 -2.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -6.4670 -2.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1630 -8.9300 -2.3700 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.5400 -9.9050 -2.9960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4190 -9.0760 -1.3100 O 0 5 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0510 1.0700 -3.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4160 1.7530 -2.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8570 0.9870 -1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9340 -0.4610 0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5670 -1.1370 0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0710 -4.0380 -4.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8260 -6.0150 -5.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -8.2720 -4.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -6.5960 -1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 11 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END