PUBCHEM-ZINC05116306 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 62 0 0 0 0 0 0 0 0999 V2000 -0.3180 1.5770 -0.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 0.1820 -0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 -0.0090 0.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8870 -1.2730 1.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 -2.3640 0.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 -2.2220 -0.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -0.9230 -1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 -0.7050 -2.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -3.3580 -1.6250 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3440 -4.1910 -1.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 -4.6690 -3.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1240 -4.3110 -3.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1450 -3.8090 -2.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -5.9060 -5.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0970 -6.8970 -5.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0060 -7.5660 -6.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1040 -8.4690 -6.7800 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 -9.1810 -7.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 -9.0940 -9.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5560 -9.8800 -10.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6400 -10.7580 -10.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8950 -11.5940 -11.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9420 -12.4240 -11.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8660 -12.5250 -10.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8220 -13.2910 -10.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5960 -11.7230 -9.1830 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2320 -11.7960 -8.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5060 -10.8410 -9.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2940 -10.0600 -7.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4510 1.9850 -1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2850 1.5780 -1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 2.2480 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 0.8340 1.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 -1.4110 2.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 -3.3500 0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1150 0.2690 -3.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -1.4400 -3.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5350 -0.7640 -2.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 -3.6450 -1.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3310 -5.0560 -1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 -3.8370 -4.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1260 -5.4220 -3.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0680 -4.8110 -3.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 -3.4940 -4.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4610 -4.6270 -1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9040 -3.0240 -1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 -6.4200 -5.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -5.0760 -5.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 -7.6670 -4.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0740 -6.4070 -5.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 -6.8010 -7.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -8.1120 -6.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 -8.4260 -9.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 -9.7980 -11.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2230 -11.5270 -12.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1590 -13.0560 -12.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9680 -10.1260 -7.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -5.3190 -3.7130 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1360 -6.0890 -3.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 11 58 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 12 58 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 47 1 0 0 0 0 14 48 1 0 0 0 0 14 58 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 17 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 29 2 0 0 0 0 19 20 2 0 0 0 0 19 53 1 0 0 0 0 20 21 1 0 0 0 0 20 54 1 0 0 0 0 21 22 1 0 0 0 0 21 28 2 0 0 0 0 22 23 2 0 0 0 0 22 55 1 0 0 0 0 23 24 1 0 0 0 0 23 56 1 0 0 0 0 24 25 2 0 0 0 0 24 26 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 29 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END