NIH-ZINC06550670 MOE2007 3D CORINA 3.40 0006 02.08.2006 71 73 0 0 1 0 0 0 0 0999 V2000 2.3260 -1.9500 -2.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4880 -0.6750 -2.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 -0.1290 -1.3840 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7490 -0.9130 -0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 1.0340 -1.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6390 2.1620 -1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0470 0.8210 -1.8080 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9740 1.9520 -1.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4020 1.4640 -1.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3700 2.6440 -1.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2760 3.2590 -3.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8470 3.7460 -3.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8800 2.5660 -3.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4470 0.3180 -0.7650 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8480 -0.2110 0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7410 -1.4380 0.3430 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5550 -1.1970 -0.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3130 -1.8940 1.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8220 -3.3550 1.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5100 -3.7420 0.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9650 -2.5270 -0.1850 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2300 1.2150 -1.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8980 1.6530 -2.4780 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5160 1.6750 -0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1770 2.6420 -1.6380 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4020 3.5900 -1.0520 S 0 0 0 0 0 0 0 0 0 0 0 0 6.8510 4.3850 -2.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9330 4.1410 0.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7370 2.5180 -0.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7000 2.2160 -1.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7480 1.3750 -1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8330 0.8360 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8660 1.1410 0.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8230 1.9860 0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8630 0.0090 0.3410 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8870 -0.5100 1.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2850 -1.7130 -2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7970 -2.6790 -2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4940 -2.3640 -3.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0370 0.0710 -3.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5480 -0.9020 -3.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 -0.0810 -1.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7120 2.7030 -1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6640 0.7120 -2.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4690 1.0260 -0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3880 2.2970 -1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1080 3.3960 -1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5380 2.5070 -3.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9650 4.1000 -3.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7810 4.1840 -4.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5860 4.4980 -2.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 2.9130 -3.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1420 1.8150 -4.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3980 0.5530 1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9600 -0.4960 1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4020 -1.8570 1.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9200 -1.2760 2.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6070 -3.9900 2.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9230 -3.4030 2.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4220 -4.0290 -0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7750 -4.5460 0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2990 2.1440 0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1710 0.8170 -0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8980 2.7280 -2.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6330 2.6360 -2.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4990 1.1390 -1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9300 0.7220 1.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0730 2.2280 1.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9410 0.3150 2.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9800 -1.0870 1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7580 -1.1540 1.7960 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