NCID-ZINC04538850 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 41 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7380 -0.4960 1.1660 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 -0.6550 0.6410 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4680 0.3190 0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0930 -1.6040 1.1220 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8080 -1.0800 1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7500 -2.0920 -0.0800 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0310 -1.6000 -1.2480 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0220 -2.3480 -2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6390 -1.3840 -0.7080 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1600 -2.3390 -0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -0.4820 -1.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6190 -0.3470 -1.7290 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3580 0.5320 -0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7190 1.5340 -1.7420 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2330 1.3530 -2.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5320 0.1500 -2.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9430 -0.2660 -4.1570 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4490 -1.1010 -4.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0400 0.4720 -5.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6860 1.6030 -5.3290 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2980 2.1110 -4.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1440 3.5970 -4.3240 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 -2.7650 1.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4870 -3.5930 2.4370 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 -0.5420 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6060 0.4140 0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5610 0.1110 -6.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 -2.3730 2.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 -3.3540 1.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1560 -4.3510 2.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9650 -0.1940 -0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -1.6320 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 -0.1830 0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 13 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 25 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 32 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 25 26 1 0 0 0 0 25 33 1 0 0 0 0 25 34 1 0 0 0 0 26 35 1 0 0 0 0 27 36 1 0 0 0 0 27 37 1 0 0 0 0 27 38 1 0 0 0 0 M END