NIH-ZINC01350599 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 40 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7680 1.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.1490 0.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -2.4700 -0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.9990 -1.4450 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -3.9310 -0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -4.8400 -1.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -6.1230 -1.4340 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -6.6330 -0.1320 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -5.8120 0.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -6.2710 2.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -4.4150 0.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -3.3380 1.5880 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -3.4260 3.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -8.0830 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3070 -8.5980 0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8580 -9.2850 -0.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1550 -9.7580 -0.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9020 -9.5440 0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3540 -8.8580 1.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0530 -8.3890 1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5140 -7.7230 2.3500 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -0.3500 2.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -4.4700 -2.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 -3.4620 3.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -4.3290 3.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5820 -2.5520 3.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -8.5620 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 -8.3120 1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2760 -9.4510 -1.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5840 -10.2940 -1.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9150 -9.9140 0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9380 -8.6910 2.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 14 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 13 2 0 0 0 0 8 9 2 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 M END