PUBCHEM-ZINC03799904 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 -0.5600 1.4510 0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2650 -0.0030 0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -0.8320 1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 -0.7050 2.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7210 -1.8800 3.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 -3.0970 2.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -3.2300 1.3350 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 -2.0920 0.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -1.9520 -0.6150 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3480 -0.6920 -0.9720 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -2.9850 -1.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 -4.3930 3.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -5.2980 3.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3480 -5.1260 2.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9610 -1.7950 4.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -2.0930 5.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 -2.0150 7.1990 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2300 -1.7180 7.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 -1.0480 7.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 -1.0750 9.4000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3940 -0.9160 9.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5830 -0.0560 10.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0170 0.4120 11.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 0.8570 11.3510 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -2.3790 9.8710 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6480 -3.0160 9.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -3.3260 7.7410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 0.6150 3.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.0160 3.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 2.2750 4.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 3.1370 4.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 2.7630 3.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3310 1.5020 3.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 4.3500 5.0360 F 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 2.0250 0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 1.7910 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 1.6850 0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -3.0490 -2.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -2.7140 -2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 -3.9440 -1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6440 -4.1820 4.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4090 -5.5900 2.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 -6.2140 4.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 -4.7950 4.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2210 -4.4780 2.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6740 -6.0130 3.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -5.4590 1.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9480 -1.4590 5.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 -2.4150 5.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 -0.0320 7.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8100 -1.3420 7.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6740 0.8450 9.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5880 -0.4710 10.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -3.9330 7.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8160 0.3460 3.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9930 2.5860 4.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0610 3.4510 3.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 1.2120 2.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8170 0.3500 12.3680 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 10 2 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 28 1 0 0 0 0 5 6 1 0 0 0 0 5 15 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 41 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 2 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 27 1 0 0 0 0 19 20 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 25 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 24 2 0 0 0 0 23 59 1 0 0 0 0 25 26 1 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 31 32 2 0 0 0 0 31 34 1 0 0 0 0 32 33 1 0 0 0 0 32 57 1 0 0 0 0 33 58 1 0 0 0 0 M CHG 1 59 -1 M END