NIH-ZINC04040493 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.8380 1.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -2.1400 0.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -2.0700 -0.7100 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.8090 -1.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -0.3760 -2.3990 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -1.3490 -3.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 -0.6100 -4.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 -1.6260 -5.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3350 -1.8480 -8.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 -1.0610 -9.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 -0.3110 -9.8600 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 0.6070 -8.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 -0.1630 -7.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -3.1920 1.5240 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -2.9460 2.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -3.8800 3.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -1.6910 3.3310 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -0.6270 2.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 0.5050 2.9530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -1.4760 4.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 -1.3840 5.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 -0.1570 5.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4340 -0.0710 5.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1060 -1.2130 6.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4700 -2.4410 6.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1600 -2.5250 5.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3120 -3.8750 6.6040 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.7470 -1.1050 6.7080 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -4.5740 1.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 0.5740 -2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 -1.9620 -3.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 -1.9860 -3.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 0.0040 -4.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 0.0280 -4.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -2.2390 -5.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 -2.2630 -5.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 -2.3760 -8.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 -2.5670 -8.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 -1.7530 -10.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 -0.3800 -9.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9980 1.1210 -8.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 1.3360 -8.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9930 -0.8550 -7.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2990 0.5390 -6.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4560 -0.5490 5.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 -2.3100 5.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 0.7350 4.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9300 0.8880 5.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 -3.4820 5.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 -4.9020 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 -5.2190 1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 -4.6270 0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 -0.9160 -7.2620 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 16 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 10 58 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 11 58 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 15 58 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 54 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 M END