NIH-ZINC04004243 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 0 0 0 0 0 0999 V2000 -0.0200 1.5180 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.0110 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 -0.4770 -1.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7850 -1.8060 -1.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3230 -2.5540 -0.5220 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 -2.3630 -2.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4590 -3.8920 -2.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -4.4560 -3.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4780 -3.8730 -3.8790 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6180 -2.4110 -3.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9270 -1.8700 -2.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5610 -4.6650 -4.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4430 -5.8740 -3.9310 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8840 -4.0690 -4.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4200 -3.7040 -5.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6720 -3.1640 -5.4110 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5880 -2.6640 -6.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6830 -2.2720 -5.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2710 -3.0450 -4.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1070 -3.6730 -3.0130 S 0 0 0 0 0 0 0 0 0 0 0 0 10.9120 -1.6750 -6.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9710 -1.3140 -5.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1120 -0.7600 -5.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2060 -0.5620 -7.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1560 -0.9190 -8.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0130 -1.4800 -7.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3250 -0.0180 -7.8230 F 0 0 0 0 0 0 0 0 0 0 0 0 5.6560 -3.8870 -6.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 1.8960 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 1.8820 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 1.8680 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 -0.3740 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 -0.3880 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9610 -2.0280 -3.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9980 -4.2290 -1.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4280 -4.2420 -2.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2120 -5.5400 -3.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 -4.1960 -4.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6750 -2.1460 -3.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1510 -1.9840 -4.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9400 -0.7810 -2.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4520 -2.2260 -1.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4510 -2.6010 -7.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8980 -1.4670 -4.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9340 -0.4790 -5.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2330 -0.7630 -9.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1970 -1.7630 -8.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6510 -4.2470 -6.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5920 -2.9330 -7.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1710 -4.6130 -7.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4620 -2.5160 -4.3300 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 21 1 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 51 2 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 M END