IBS-ZINC04772814 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 1 0 0 0 0 0999 V2000 -0.0100 1.5200 0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.0110 0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1640 -0.0340 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1780 1.4970 1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7720 3.4630 1.3540 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1800 3.8890 0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 3.9490 1.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4130 5.6520 2.1860 S 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 6.0080 3.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 6.5120 1.1100 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0840 5.2330 3.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6080 3.9230 2.5500 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6380 4.0700 2.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5810 2.9050 3.5530 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 -1.9770 -0.0310 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9120 -2.4080 0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8670 -2.4780 -0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6670 -4.1810 -0.7660 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.6400 -4.4190 -1.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5390 -5.0860 0.3210 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 -3.9320 -1.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6980 -2.4460 -1.3160 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3800 -2.3250 -1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1580 -1.6710 -2.4260 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 1.8920 0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4570 1.8820 -0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5630 -0.3670 -0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4760 -0.3730 1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7170 -0.3960 2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1860 -0.4060 1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6500 1.8590 0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7380 1.8530 2.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 3.3360 2.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 3.9650 0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 5.0870 4.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8310 6.0210 3.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0890 3.1210 4.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3310 -2.4910 0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4440 -1.8660 -0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -4.5670 -1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 -4.1460 -2.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 -1.9140 -3.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3770 -0.5100 0.0520 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 1.9960 1.2710 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 44 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 43 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 4 44 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 5 44 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 22 1 0 0 0 0 15 43 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 42 1 0 0 0 0 M END