PUBCHEM-ZINC01444052 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 63 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.0990 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5460 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 -1.9280 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 -2.6690 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 -2.0280 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -2.7560 -0.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 -4.1790 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2130 -2.7450 0.0390 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.9830 -4.0410 0.5740 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1420 -1.8270 0.5970 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6630 -2.9640 -1.5400 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2690 -4.2000 -2.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4080 -5.1280 -2.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6120 -4.4920 -3.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2710 -3.6220 -2.1250 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.9610 -2.1690 -2.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4400 -1.9600 -2.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4140 -4.2560 -1.1080 S 0 0 0 0 0 0 0 0 0 0 0 0 -10.2560 -3.1770 -0.7280 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.8980 -5.4360 -1.7340 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5800 -4.7760 0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4250 -3.8960 1.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7710 -4.2980 2.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2700 -5.5860 2.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4260 -6.4720 1.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0870 -6.0640 0.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9350 -7.7370 1.6850 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1320 -8.5910 0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6260 -5.9840 3.7860 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5020 -5.0210 4.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 1.1790 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0290 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5310 -3.7480 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7470 -4.6370 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 -4.5010 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 -4.4840 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9380 -3.9430 -3.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4500 -4.6820 -1.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1000 -6.0190 -2.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7060 -5.4170 -1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2690 -3.9170 -3.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3000 -5.2710 -3.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4910 -1.6390 -2.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2760 -1.7840 -1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1770 -0.9820 -1.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1980 -1.9780 -3.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8160 -2.8910 1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6510 -3.6080 3.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2130 -6.7510 -0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6940 -9.5690 0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2000 -8.7040 0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6530 -8.1530 -0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9480 -4.1560 4.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4940 -4.7060 5.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9700 -5.4660 5.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 27 28 2 0 0 0 0 27 32 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 32 33 1 0 0 0 0 33 59 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 M END