NIH-ZINC06507061 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 64 0 0 1 0 0 0 0 0999 V2000 0.6020 0.5600 0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3860 -0.1450 1.1030 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -0.4060 2.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6250 -0.4940 0.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7830 -0.0900 1.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0670 -0.3520 0.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2170 -1.0320 -0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0920 -1.4630 -1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7890 -1.2240 -0.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5910 -1.7530 -1.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 -2.9440 -2.2930 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0240 -3.0870 -2.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0750 -4.2650 -1.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 -5.4480 -2.4520 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5290 -5.5300 -3.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 -6.8130 -1.7270 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6490 -6.9990 -1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5700 -7.9050 -2.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 -9.0410 -2.5580 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1750 -7.5430 -4.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0180 -6.3210 -4.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6520 -5.1580 -3.2860 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3920 -3.8440 -4.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3230 -3.7810 -5.2600 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1080 -2.6280 -3.1750 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3070 -2.2080 -2.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4620 -2.4630 -2.7110 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7390 -5.0690 -2.3510 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0460 -6.2910 -4.8880 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9040 -8.2920 -5.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3700 -7.9250 -6.4320 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1580 -9.4260 -5.1970 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6430 -8.0420 -0.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3920 -6.5620 0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4970 -1.2590 -0.8210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 -0.1270 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 1.0620 -0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 1.3360 0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 0.3980 3.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 -1.3580 2.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 -0.4680 2.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6870 0.4820 2.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9380 -0.0110 1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 -0.9350 -1.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 -2.0620 -0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 -4.4820 -0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8730 -4.1390 -0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8720 -1.7910 -3.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4930 -4.6590 -2.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2360 -8.6880 -7.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 -9.9230 -6.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8470 -9.7920 -4.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0530 -8.9170 -0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0370 -8.1260 -1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4770 -7.8980 -0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7500 -5.6830 0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8660 -7.4410 1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3150 -6.3850 1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4330 -1.7650 -1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7600 -6.8170 -0.7850 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.3690 -6.0240 -1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 25 1 0 0 0 0 13 14 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 22 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 60 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 30 2 0 0 0 0 21 22 1 0 0 0 0 21 29 2 0 0 0 0 22 23 1 0 0 0 0 22 28 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 28 49 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 31 50 1 0 0 0 0 32 51 1 0 0 0 0 32 52 1 0 0 0 0 33 53 1 0 0 0 0 33 54 1 0 0 0 0 33 55 1 0 0 0 0 33 60 1 0 0 0 0 34 56 1 0 0 0 0 34 57 1 0 0 0 0 34 58 1 0 0 0 0 34 60 1 0 0 0 0 35 59 1 0 0 0 0 60 61 1 0 0 0 0 M CHG 1 60 1 M END