PUBCHEM-ZINC06308267 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 0 0 0 0 0 0999 V2000 -0.8120 1.9780 0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.7430 0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 0.5770 2.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4380 0.2030 2.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 0.7180 3.6500 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1710 -0.8970 1.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 -2.2690 2.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0950 -3.0610 2.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4860 -2.6130 4.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7940 -3.1820 4.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0500 -4.3340 5.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4160 -4.3870 5.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9660 -3.3450 5.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9410 -2.5710 4.4780 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2570 -5.3960 6.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4130 -6.6770 6.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9960 -6.4000 7.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2360 -5.3410 6.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0110 -5.3130 6.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 -2.6430 2.5410 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 -3.9380 3.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 -4.8460 1.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 -6.1630 2.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 -6.4830 3.5320 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9190 -0.8920 0.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7860 -1.2730 -0.3720 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 -0.5250 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 0.9560 0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4230 2.8900 0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7610 2.1160 -0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8690 1.8950 0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6390 -0.2030 2.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 1.5100 2.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9200 -2.8810 2.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9060 -4.1370 2.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6970 -2.8940 5.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5450 -1.5180 4.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5640 -5.0260 7.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1600 -5.6110 5.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9330 -7.3810 7.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3210 -7.1650 5.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0540 -6.0490 8.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4150 -7.3280 7.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2380 -0.6640 2.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 -3.7670 3.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9750 -4.4040 3.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 -5.0800 1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 -4.3210 1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5720 -0.3810 -1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -1.3840 0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 1.8510 0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0910 0.1030 0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 1.0780 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 -6.7850 1.3760 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 7 20 2 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 11 12 2 0 0 0 0 11 18 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 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 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 23 54 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 M CHG 1 54 -1 M END