PUBCHEM-ZINC01853477 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 55 0 0 1 0 0 0 0 0999 V2000 -5.6190 2.1420 2.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2820 0.7770 1.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3310 -0.2660 1.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9920 -1.6370 1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0350 -2.5530 0.7610 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4840 -3.8290 0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6090 -4.1970 0.9170 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4640 -4.5700 0.0800 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4580 -5.9370 -0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5560 -6.7780 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4660 -8.1330 -0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2740 -8.6630 -0.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1830 -7.8240 -1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2750 -6.4670 -0.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2940 -10.0060 -1.1290 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0340 -10.6750 -1.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3550 -12.1250 -0.6720 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0370 -12.5640 -1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1000 -12.9830 -0.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 -14.9220 1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 -14.0270 2.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4150 -15.4470 0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2140 -16.0950 1.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0410 -12.1810 0.6020 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7190 -11.4710 0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3170 2.8740 2.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7370 2.1060 2.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3050 2.4970 1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6120 0.4670 2.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1770 0.8560 1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9880 0.0430 0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4280 -0.3430 2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2950 -1.9830 2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8690 -1.5870 0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6240 -4.0320 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4980 -6.4140 0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3290 -8.7770 -0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2550 -8.1950 -1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 -5.8310 -0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 -10.6120 -1.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4290 -10.2400 -0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7180 -13.3620 -1.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3200 -12.4380 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2630 -13.2170 1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6360 -13.5770 2.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 -14.6070 2.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3050 -16.0870 0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8650 -16.0400 -0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 -14.6310 -0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0040 -15.7420 2.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6800 -16.7470 1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5250 -16.7100 2.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5130 -14.1480 0.3460 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.2030 -13.7060 0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0820 -14.7910 -0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 24 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 53 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 20 53 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 53 54 1 0 0 0 0 53 55 1 0 0 0 0 M CHG 1 53 1 M END