NIH-ZINC05358239 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 0.1010 1.4480 -0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 0.0300 -0.5660 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1070 -0.5660 -0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3080 0.0910 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4660 -0.6460 0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4410 -2.0510 0.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2250 -2.7130 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0700 -1.9660 -0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2760 -4.0820 0.0630 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0840 -4.7940 -0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7160 -2.8170 0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5480 -3.4050 2.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9390 -3.5030 3.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9990 -4.3610 4.3120 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5790 -4.0460 4.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1680 -3.9300 2.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4400 -5.4070 5.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5360 -6.1380 5.7770 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9920 -7.1510 6.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3170 -7.4810 6.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1690 -6.6960 5.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7600 -5.6710 5.1460 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 1.7540 -0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 1.7800 -1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 1.9250 0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3790 1.1740 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3940 -0.1060 0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 -2.4440 -0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3110 -5.8630 -0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7490 -4.5760 -1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 -4.5840 0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5430 -2.2780 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7040 -3.8200 0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6460 -4.3730 1.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1640 -2.6570 1.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9170 -2.5040 4.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9770 -3.8480 3.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3880 -3.0930 4.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9260 -4.7890 4.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1500 -3.5370 2.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2330 -4.8990 2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2270 -7.7060 7.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6640 -8.2970 7.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2410 -6.8670 5.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0910 -2.9680 1.9690 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.9910 -2.0430 2.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 16 45 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 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 45 1 M END