PUBCHEM-ZINC00624728 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.2050 0.9800 -1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -0.3870 -0.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2430 -0.5470 0.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 -1.8220 1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 -2.9660 0.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 -2.8120 -0.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 -1.5220 -1.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 -3.9850 -1.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.2700 0.9920 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -4.6400 2.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 -3.8980 3.2850 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 -6.1400 2.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 -6.9530 2.5480 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 -8.6150 2.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3230 -9.5570 3.0950 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -10.8080 2.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2060 -11.7930 3.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 -13.1250 3.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 -13.4890 2.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 -12.5190 1.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -11.1640 1.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9410 -10.1040 0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -8.8260 1.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 -10.3430 -0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2520 -11.3440 -1.3090 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7590 1.3790 -1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 0.9500 -2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 1.6660 -0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2930 0.3190 1.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 -1.8820 2.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 -1.3990 -2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 -4.6720 -1.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -3.6680 -2.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0490 -4.5140 -1.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 -5.0290 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6450 -6.5000 1.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6330 -6.3400 3.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7150 -11.5170 4.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -13.8700 4.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 -14.5210 2.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6110 -12.8290 0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5430 -9.5190 -0.9490 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 31 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 23 2 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 42 2 0 0 0 0 M CHG 1 25 -1 M END