PUBCHEM-ZINC05392891 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 1 0 0 0 0 0999 V2000 1.4660 0.1170 -0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4840 -0.2570 0.4180 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4930 -1.1010 0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4260 -1.5530 0.2320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5850 -1.4440 2.2620 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 -2.2680 2.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 -3.7150 2.4120 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5710 -4.0430 2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0990 -4.6610 3.4350 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1230 -4.3340 3.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0850 -6.1200 2.9940 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2120 -6.2620 1.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 -6.6600 3.5240 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0140 -6.3220 2.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 -5.7780 4.7890 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5140 -5.4240 4.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 -4.5930 4.6610 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 -6.3190 6.1080 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0070 -6.5650 6.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9070 -7.0170 7.9050 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 -7.0800 8.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 -6.6500 7.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5040 -6.5590 6.9300 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1070 -6.9640 8.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5420 -7.4070 9.2050 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 -7.4740 9.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 -7.9170 10.4290 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -7.9550 3.7870 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.1420 -6.8460 3.6410 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6450 -7.6850 3.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 -3.7720 1.1990 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9810 -2.9700 0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3640 0.1710 1.1410 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2660 0.9170 0.7430 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3740 1.2050 -1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 -0.2210 -1.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 -0.3400 -1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3690 -1.1120 2.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -2.2310 4.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 -1.7820 2.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9320 -6.3840 6.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1920 -6.9280 8.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 -7.9720 10.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 -8.1800 11.1980 H 0 0 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 33 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 31 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 17 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 29 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 28 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 29 30 1 0 0 0 0 31 32 1 0 0 0 0 33 34 2 0 0 0 0 M CHG 1 28 -1 M END