PUBCHEM-ZINC05890742 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 0 0 0 0 0 0999 V2000 0.1130 1.2620 1.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 0.0950 0.4990 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0930 -0.5560 0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1810 -1.6980 -0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3810 -2.3620 -0.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5130 -1.8860 0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4190 -0.7360 0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2130 -0.0820 1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7970 -2.5900 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9590 -1.9030 0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9430 -0.4350 0.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2600 0.1450 1.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5770 0.2690 -0.9270 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4560 1.7270 -0.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0300 2.2760 -2.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9030 3.7980 -2.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4960 4.3240 -3.4390 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.3300 4.7050 -4.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5870 5.1300 -5.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2760 4.9970 -5.0870 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5010 5.2210 -5.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2640 4.5000 -3.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1760 -2.5920 0.1790 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3290 -1.9100 0.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3210 -0.6950 0.3300 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6030 -2.6410 0.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8000 -1.9390 0.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9860 -2.6270 0.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9910 -4.0110 0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8090 -4.7130 0.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6170 -4.0370 0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 1.6840 1.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5880 1.9980 0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1760 0.9930 2.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3060 -2.0650 -0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4480 -3.2490 -1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2900 -0.3640 1.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1380 0.8030 1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8130 -3.6550 -0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3940 -0.1900 -1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4170 2.1570 -0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7070 1.9900 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0690 1.8450 -2.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7790 2.0130 -2.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8640 4.2290 -1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1550 4.0620 -1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4090 4.6770 -4.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9550 5.5020 -6.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3810 4.2830 -3.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1890 -3.5600 0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7960 -0.8590 0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9120 -2.0850 0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9220 -4.5450 0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8200 -5.7930 0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6950 -4.5870 0.3600 H 0 0 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 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 31 2 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 30 2 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 30 54 1 0 0 0 0 31 55 1 0 0 0 0 M CHG 1 17 1 M END