PUBCHEM-ZINC02012701 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 0 0 0 0 0 0999 V2000 0.1410 0.8240 -1.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 -0.2630 -1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 -0.6690 -0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0970 0.0190 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3530 1.1320 -0.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 1.5100 -1.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 1.8810 -0.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 3.2190 -0.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9200 3.9970 -0.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9300 5.2530 -1.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0840 6.0470 -1.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2580 5.6100 -0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2370 4.3550 -0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0820 3.5620 -0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4680 6.4460 -0.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6700 5.9880 -1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8230 6.7830 -1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8050 8.0600 -0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6140 8.5170 -0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4590 7.7230 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0490 8.8400 -0.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1070 10.1750 -0.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3740 10.9240 -0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4100 10.5180 -1.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6280 11.2020 -1.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8340 12.3140 -0.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8200 12.7480 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5950 12.0620 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3210 12.6850 1.1460 S 0 0 0 0 0 0 0 0 0 0 0 0 11.2380 13.0400 0.2320 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0770 11.5380 2.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3200 -0.5680 1.1540 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4410 -0.9510 0.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5280 0.6060 1.9960 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6130 1.1370 -2.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 -0.7990 -1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -1.5230 0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 2.3440 -2.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5230 1.2780 -0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 3.8030 -0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0400 5.6260 -1.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0600 7.0120 -1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1210 3.9910 0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0990 2.6080 0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7180 5.0060 -1.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7370 6.3930 -1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5720 9.4890 0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5520 8.1050 0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9610 8.2580 -0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2080 10.7760 -0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2730 9.6630 -2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4130 10.8660 -2.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7790 12.8480 -0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9890 13.6220 0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9640 13.8220 1.8010 O 0 5 0 0 0 0 0 0 0 0 0 0 2.6470 -1.6840 1.8160 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 2 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 27 2 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 29 31 2 0 0 0 0 29 55 1 0 0 0 0 32 33 2 0 0 0 0 32 34 2 0 0 0 0 32 56 1 0 0 0 0 M CHG 1 55 -1 M CHG 1 56 -1 M END