NIH-ZINC00235901 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 23 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 -0.6890 1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0540 1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.7300 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -4.1320 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -4.7520 -1.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -4.0130 -2.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -2.6480 -2.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -1.9720 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6370 -1.1470 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0330 0.1100 -2.3500 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.0060 -1.9440 -3.6050 O 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 0.0250 -0.1400 2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6010 2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -4.7180 0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -5.8300 -1.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -4.5280 -3.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 -1.7520 -3.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 11 2 0 0 0 0 3 4 2 0 0 0 0 3 17 1 0 0 0 0 4 5 1 0 0 0 0 4 18 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 19 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 8 9 2 0 0 0 0 8 21 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 13 22 1 0 0 0 0 M CHG 1 11 1 M CHG 1 12 -1 M END