NIH-ZINC04893366 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4170 -1.9800 -0.1140 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6080 -2.6070 -0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6340 -1.9630 -0.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6630 -3.9480 -0.2370 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5050 -4.8460 -0.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0520 -6.2830 -0.4920 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0570 -6.7830 0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5000 -6.0600 -1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8940 -4.7600 -0.2530 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2120 -4.9870 0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9880 -4.0380 -0.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7130 -3.1330 -1.7480 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 -7.0300 -1.4400 O 0 0 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 -0.2570 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -0.1020 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -4.5860 -1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 -4.7670 0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5150 -5.9120 -2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1480 -6.8870 -0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 -7.1320 -1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2690 -4.4000 -0.8230 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9360 -3.9080 -1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 21 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 17 31 1 0 0 0 0 32 33 1 0 0 0 0 M END