PUBCHEM-ZINC05593080 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 67 0 0 1 0 0 0 0 0999 V2000 0.0220 1.5600 0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 0.0310 0.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -0.4950 1.4340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 -1.8470 1.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4740 -2.4260 2.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5770 -3.8010 2.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 -4.6000 1.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3810 -4.0250 0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 -2.6510 0.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -6.1000 1.7980 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4720 -6.5870 1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0460 -7.4510 0.0740 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7720 -7.5060 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 -6.7540 0.9550 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 -6.6300 1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8720 -7.0680 2.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2370 -6.9470 2.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9980 -6.3830 1.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3760 -5.9440 0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0100 -6.0630 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4680 -6.2520 1.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2300 -5.6890 0.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5970 -5.5690 0.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2100 -6.0070 1.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4590 -6.5660 2.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0920 -6.6960 2.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -8.3380 -1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3060 -9.8130 -0.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -10.2290 -1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8510 -9.6520 -0.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9780 -8.1480 -0.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 -6.5260 3.1570 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 1.9320 0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 1.9610 -0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 1.8740 1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 -0.3410 0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5480 -0.2830 -0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9010 -1.8020 3.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0840 -4.2520 3.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -4.6520 -0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 -2.2030 -0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0540 -5.7440 0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0450 -7.1570 1.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 -7.5040 3.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7170 -7.2880 3.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9640 -5.5070 -0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 -5.7180 -0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7520 -5.3470 -0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1890 -5.1330 -0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2800 -5.9100 1.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9430 -6.9060 3.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5060 -7.1380 3.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 -8.1480 -0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 -8.0840 -2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 -9.9730 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 -10.4250 -1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7170 -11.3160 -1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6980 -9.9250 -2.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7430 -9.8230 0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7520 -10.1530 -0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7130 -7.9290 -1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -7.8250 -0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6990 -6.1520 3.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 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 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 15 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 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 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 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 25 2 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 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 29 30 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 30 59 1 0 0 0 0 30 60 1 0 0 0 0 31 61 1 0 0 0 0 31 62 1 0 0 0 0 32 63 1 0 0 0 0 M CHG 1 12 1 M END