NCID-ZINC04946635 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4610 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 -0.7130 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1440 -2.0350 -0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2650 -2.7500 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5010 -2.0840 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5000 -0.6770 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3330 -0.0420 0.0160 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0150 0.2230 0.0470 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.3740 1.9160 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5240 2.8890 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0360 3.3320 1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0920 4.2250 1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6350 4.6740 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1220 4.2320 -1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0640 3.3430 -1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4680 -3.0340 0.0320 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9160 -4.2120 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5570 -4.0900 0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5880 -5.1890 -0.0110 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7770 -4.9690 -0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0310 -5.4340 1.4080 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0090 -5.7580 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9230 -6.5620 1.9730 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4570 -6.2190 2.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9140 -6.8650 0.8280 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8390 -6.3040 0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2380 -6.4270 -0.3740 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2070 -8.3650 0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2120 -8.6100 -0.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1380 -7.7160 2.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1490 -4.2530 2.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8380 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 1.8190 -0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 1.8150 0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 -0.4780 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7530 2.0720 0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7760 2.0760 -0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6120 2.9810 2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4920 4.5710 2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4600 5.3710 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5460 4.5830 -2.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6610 3.0000 -2.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4540 -5.1490 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2970 -8.9010 0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5600 -8.7110 1.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4480 -9.5430 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6480 -8.4560 2.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 -4.3500 3.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 6 7 2 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 28 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 32 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 31 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 29 30 1 0 0 0 0 29 45 1 0 0 0 0 29 46 1 0 0 0 0 30 47 1 0 0 0 0 31 48 1 0 0 0 0 32 49 1 0 0 0 0 M END