NIH-ZINC06550658 MOE2007 3D CORINA 3.40 0006 02.08.2006 71 73 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 0.7180 -0.4980 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7100 -0.0490 -1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8470 -1.9980 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3430 -2.6800 -2.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 -2.5820 -0.1960 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6480 -4.0410 -0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8700 -4.4850 1.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0010 -6.0080 1.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1910 -6.4480 0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9700 -6.0040 -0.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8380 -4.4800 -1.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 -0.1140 -2.4400 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 -0.5930 -2.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3970 0.4040 -1.9650 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1200 0.5880 -0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8470 -0.1220 -2.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6920 1.1440 -2.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6530 2.2860 -2.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4080 1.6420 -2.7090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 0.6800 -3.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 1.0770 -3.2430 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 1.0750 -4.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 1.9330 -5.4570 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 2.2160 -7.0220 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 3.1000 -7.5710 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 0.9480 -7.5870 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4560 3.1120 -6.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 4.4940 -6.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6280 5.1980 -6.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8370 4.5180 -6.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8500 3.1310 -6.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6600 2.4310 -6.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0060 5.2080 -6.8320 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2120 4.4420 -6.8190 C 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 -2.0370 0.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 -4.4980 -0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7820 -4.0290 1.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 -4.1720 1.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1590 -6.3250 2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0890 -6.4650 0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1030 -5.9910 0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2840 -7.5330 0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8170 -6.3160 -1.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 -6.4600 -1.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6810 -4.1640 -2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7500 -4.0240 -0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6560 -0.6900 -3.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 -1.5640 -2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9490 -0.8280 -2.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1400 -0.5880 -1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2120 1.0640 -3.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4020 1.3040 -1.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9280 3.0210 -3.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5690 2.7600 -1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 0.1800 -5.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1910 1.6160 -4.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 2.3360 -5.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 5.0240 -6.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6160 6.2780 -6.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7890 2.5990 -6.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6690 1.3520 -6.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2660 3.8330 -7.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2220 3.7940 -5.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0700 5.1140 -6.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 40 1 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 14 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 44 1 0 0 0 0 9 45 1 0 0 0 0 10 11 1 0 0 0 0 10 46 1 0 0 0 0 10 47 1 0 0 0 0 11 12 1 0 0 0 0 11 48 1 0 0 0 0 11 49 1 0 0 0 0 12 13 1 0 0 0 0 12 50 1 0 0 0 0 12 51 1 0 0 0 0 13 52 1 0 0 0 0 13 53 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 54 1 0 0 0 0 15 55 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 18 19 1 0 0 0 0 18 56 1 0 0 0 0 18 57 1 0 0 0 0 19 20 1 0 0 0 0 19 58 1 0 0 0 0 19 59 1 0 0 0 0 20 21 1 0 0 0 0 20 60 1 0 0 0 0 20 61 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 62 1 0 0 0 0 24 63 1 0 0 0 0 25 26 1 0 0 0 0 25 64 1 0 0 0 0 26 27 2 0 0 0 0 26 28 2 0 0 0 0 26 29 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 65 1 0 0 0 0 31 32 1 0 0 0 0 31 66 1 0 0 0 0 32 33 2 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 33 67 1 0 0 0 0 34 68 1 0 0 0 0 35 36 1 0 0 0 0 36 69 1 0 0 0 0 36 70 1 0 0 0 0 36 71 1 0 0 0 0 M END