NIH-ZINC06530963 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5600 -1.7290 0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2570 -0.7310 -1.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3340 -0.2280 -1.6820 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5480 -1.3110 -2.4300 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0780 -1.3340 -3.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 -2.0340 -4.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1070 -1.3170 -5.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 -2.0030 -6.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3720 -3.3700 -6.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3290 -4.0200 -5.6900 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1850 -3.3990 -4.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6620 -0.0260 0.8450 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8490 -0.5320 2.4110 S 0 0 0 0 0 0 0 0 0 0 0 0 5.8520 0.2950 2.9840 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5400 -0.6550 2.9510 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5190 -2.1610 2.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8900 -2.3430 2.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4190 -3.6180 2.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5720 -4.7180 2.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -4.5320 2.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6730 -3.2550 2.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2780 -5.7250 2.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9140 -6.8320 1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3410 -7.0460 1.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8110 -8.1640 1.8070 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1010 -6.0120 2.2270 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 -1.7130 -2.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2290 -0.3120 -4.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0300 -1.8660 -3.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 -0.2490 -5.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4430 -1.4770 -6.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 -3.9120 -6.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9590 -3.9640 -4.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1830 0.7220 0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5480 -1.4870 2.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4900 -3.7590 2.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6030 -3.1100 2.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1120 -6.0900 3.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3250 -5.4360 1.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3530 -7.7570 1.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8910 -6.5460 0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0230 -6.1640 2.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 19 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 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 47 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 26 33 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 30 31 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 54 1 0 0 0 0 M END