PUBCHEM-ZINC05820827 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 56 0 0 1 0 0 0 0 0999 V2000 -0.7810 1.4850 -1.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 0.2230 -0.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 -0.6820 -0.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6320 -1.9510 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8660 -2.8560 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7080 -4.1150 0.8070 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4900 -3.8510 1.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9920 -4.9490 0.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0590 -6.0040 0.1370 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0430 -4.4480 1.5110 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8980 -3.6020 2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3620 -5.0790 1.5250 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.7100 -5.0960 0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3330 -6.5190 2.0750 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6630 -6.6050 2.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7700 -6.8190 2.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3310 -5.4540 2.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4590 -5.2880 3.1990 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3540 -4.3350 2.4350 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.8710 -4.0340 3.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9960 -3.1410 1.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8080 -2.2590 2.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6570 -0.9280 2.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5530 -0.0520 3.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7780 0.9310 4.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7360 1.8220 5.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0990 2.9170 6.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8440 3.0240 6.0510 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9210 -7.4500 1.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1260 -7.0680 0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6220 -4.8970 0.3190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 2.1170 -1.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 1.2420 -2.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6370 2.0660 -1.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 -0.3170 -1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3980 0.5020 0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7040 -0.1360 -0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0170 -0.9560 -1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7490 -2.4930 -0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 -1.6770 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7510 -2.2920 0.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0310 -3.1440 -1.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3350 -7.2880 1.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8140 -7.4450 3.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2140 -2.5450 1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6620 -3.4990 0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6050 -2.7420 3.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8920 -0.4220 2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1990 0.5130 2.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2130 -0.6630 4.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1270 0.3820 5.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1250 1.5540 3.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4210 2.3240 4.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3490 1.1950 5.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0020 -5.5260 -0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9320 3.5930 6.7790 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 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 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 31 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 29 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 2 0 0 0 0 27 56 1 0 0 0 0 29 30 1 0 0 0 0 31 55 1 0 0 0 0 M CHG 1 56 -1 M END