NIH-ZINC01361831 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 -0.0090 1.4940 0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -0.0070 0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.5970 -1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -1.9780 -1.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7240 -0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -2.1240 1.0840 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -0.8100 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -4.1170 -0.1630 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -4.8440 0.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -4.2920 2.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 -6.3430 0.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4300 -6.8960 2.2360 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7150 -7.2750 2.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9300 -7.4390 2.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0470 -7.8120 3.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9530 -8.0220 4.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 -7.8590 5.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 -7.4870 4.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 -7.3260 4.9470 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7460 -7.6560 4.1880 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8280 -8.7390 4.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6430 -7.0550 2.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6450 -6.7100 2.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9860 -7.1050 4.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0410 1.8430 0.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 1.7810 1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 1.9420 -0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 0.0080 -2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.4700 -2.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -0.3550 2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -4.5620 -1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 -6.7600 0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -6.5980 0.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0060 -7.2750 1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9960 -7.9400 2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8290 -8.3120 4.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6720 -8.0230 6.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0630 -7.5450 5.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8750 -7.3560 4.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 -6.0220 4.9820 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 24 1 0 0 0 0 22 23 2 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 M END