NIH-ZINC06578216 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 0 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 2.3970 0.0290 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4120 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 2.1840 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2020 2.2350 -1.3860 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3590 2.8780 -1.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9620 3.4150 -0.7300 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9040 2.9310 -3.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2190 3.7150 -3.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7880 3.7370 -4.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7640 4.2670 -5.3800 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4330 3.6430 -5.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8910 3.6220 -3.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1020 5.5430 -6.3790 S 0 0 0 0 0 0 0 0 0 0 0 0 5.8560 6.1520 -6.6890 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1830 6.2450 -5.7810 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7180 4.8740 -7.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8430 4.5680 -8.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3220 4.0440 -10.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6840 3.8260 -10.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5590 4.1340 -9.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0750 4.6630 -8.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0370 3.8980 -9.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2570 2.6590 -10.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3990 2.7400 -11.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8160 2.2980 -12.5540 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1750 3.2960 -11.4570 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9120 -0.8180 -0.0380 Cl 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 1.2220 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 3.1660 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4920 3.1980 0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3930 1.6910 0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7190 1.8060 -2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0840 1.9170 -3.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0350 4.7360 -2.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9320 3.2350 -2.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6700 4.3760 -4.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0560 2.7240 -4.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7620 4.2200 -6.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5100 2.6230 -5.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9480 3.0760 -3.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7290 4.6440 -3.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7840 4.7380 -8.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6380 3.8050 -10.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7560 4.9070 -7.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4890 4.7640 -9.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4970 3.7430 -8.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3060 2.6030 -10.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9920 1.7670 -9.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6290 3.3290 -12.2580 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 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 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 16 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 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 30 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 55 1 0 0 0 0 M END