PUBCHEM-ZINC05887395 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 53 0 0 1 0 0 0 0 0999 V2000 0.8590 -0.9530 1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -0.2590 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -0.3560 -1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 -0.8740 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2540 -0.2720 -1.1520 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8350 -0.3650 -2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6280 -0.9480 -1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5900 -0.3650 -0.6240 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6870 -2.1920 -1.7060 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8520 -2.6870 -2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9550 -2.8970 -1.9160 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6870 -2.5470 -1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4870 -2.7100 -3.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6870 -1.2660 -3.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8110 -0.6530 -4.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9780 0.6880 -5.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0220 1.4270 -4.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9010 0.8270 -3.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7360 -0.5140 -3.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6770 -4.3880 -1.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5540 -4.8690 -1.8330 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7860 -5.1330 -1.3550 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7100 -6.5660 -1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0890 -7.0870 -0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0400 -6.3100 -0.6470 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1640 -8.5820 -0.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8590 -9.1760 -0.2870 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8490 -0.5010 1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 -0.8630 2.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 -2.0190 0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 0.8000 0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 -1.3910 -1.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3830 0.2450 -2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8740 0.0170 -1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 -1.9520 -0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8290 -0.7930 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8020 -3.1900 -4.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4420 -3.2390 -3.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9940 -1.2170 -5.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3020 1.1520 -5.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1580 2.4690 -4.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7180 1.4040 -3.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4290 -0.9650 -2.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7050 -4.7080 -1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3770 -7.0400 -2.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9980 -6.7660 -0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7230 -9.1070 -1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5880 -8.8110 0.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5500 -10.4630 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4400 1.1970 -0.9060 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.0960 1.5840 -1.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5720 1.7440 -0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9010 1.3400 0.0050 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 4 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 50 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 20 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 50 51 1 0 0 0 0 50 52 1 0 0 0 0 50 53 1 0 0 0 0 M CHG 1 50 1 M END