PUBCHEM-ZINC03871754 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 70 0 0 1 0 0 0 0 0999 V2000 -1.1120 -2.0980 -1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -3.3490 -1.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 -3.5590 -1.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6260 -2.5200 -0.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9930 -2.7190 -0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7800 -1.6650 -0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2260 -0.4110 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8670 -0.2050 -0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 -1.2470 -0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 -1.0530 -0.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4950 -1.9550 0.0740 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0660 -0.7440 0.6240 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5730 -3.2160 0.7790 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1190 -2.1950 -1.4760 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5290 -1.0240 -2.3150 C 0 0 3 0 0 0 0 0 0 0 0 0 6.7670 -0.1630 -1.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3980 -0.7020 -3.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8820 -1.8980 -3.8790 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8910 -2.5620 -3.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8000 -1.4530 -3.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1460 -2.6410 -3.0640 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5340 -0.4820 -3.7280 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3540 0.9630 -3.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7130 1.5220 -4.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1780 0.5480 -5.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6800 -0.8170 -4.5870 C 0 0 3 0 0 0 0 0 0 0 0 0 10.4410 -1.2820 -3.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3280 -1.7570 -5.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4470 -2.0360 -6.6390 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2790 -2.8780 -7.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2210 -3.4370 -7.9850 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5380 -3.0290 -8.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2960 -3.9100 -9.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4910 -3.9100 -10.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3800 -4.3280 -12.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7240 -3.1490 -12.9040 N 0 3 0 0 0 0 0 0 0 0 0 0 10.0950 -2.8880 -13.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8380 -2.4890 -12.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1870 -5.1640 -13.9560 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6390 -6.0680 -14.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5610 -4.9210 -14.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1720 -1.9350 -1.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1700 -4.1630 -2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -4.5450 -1.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4450 -3.6940 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8290 0.4080 0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4410 0.7770 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 -0.0850 -0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7260 -3.0230 -1.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5700 -0.2120 -2.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7160 -0.0450 -4.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5900 1.2560 -4.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0450 1.2770 -2.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6590 2.5550 -4.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3950 1.4860 -3.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7090 0.8100 -6.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2630 0.5690 -5.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9660 -2.7220 -5.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5180 -1.3320 -6.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3520 -1.6150 -6.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8600 -2.0280 -8.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3250 -3.4580 -7.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0800 -4.9380 -9.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3990 -3.5700 -10.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7860 -2.8990 -11.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3590 -4.3620 -10.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2240 -4.6950 -11.9190 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7440 -5.5550 -12.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 2 0 0 0 0 1 42 1 0 0 0 0 2 3 2 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 3 44 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 45 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 2 0 0 0 0 7 46 1 0 0 0 0 8 9 1 0 0 0 0 8 47 1 0 0 0 0 9 10 1 0 0 0 0 10 48 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 49 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 20 1 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 18 19 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 26 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 25 26 1 0 0 0 0 25 56 1 0 0 0 0 25 57 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 29 30 1 0 0 0 0 29 60 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 32 61 1 0 0 0 0 32 62 1 0 0 0 0 33 34 1 0 0 0 0 33 63 1 0 0 0 0 33 64 1 0 0 0 0 34 65 1 0 0 0 0 34 66 1 0 0 0 0 34 67 1 0 0 0 0 35 36 2 0 0 0 0 35 39 1 0 0 0 0 35 67 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 39 40 1 0 0 0 0 39 41 1 0 0 0 0 67 68 1 0 0 0 0 M CHG 1 36 1 M END