PUBCHEM-ZINC05420384 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 1 0 0 0 0 0999 V2000 -0.1170 1.4300 -0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 -0.0630 0.0260 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8540 -0.5850 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 -0.4510 1.2400 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6360 -1.4290 1.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3280 -0.6090 0.7140 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1320 -0.6960 -0.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8840 -0.5520 -1.0710 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1900 -0.9380 -1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9230 -1.0640 -2.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9700 -1.3030 -3.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2830 -1.4190 -3.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5400 -1.2920 -1.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5070 -1.0510 -1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8500 -0.9320 0.2440 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8240 -1.4060 -1.5330 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9530 0.5500 2.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 1.2600 2.6560 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 0.6220 3.1300 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3840 1.5080 4.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7450 2.9200 3.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 3.9220 4.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 4.6020 5.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7830 4.6170 4.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 5.4030 6.1130 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 6.0250 6.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 5.2540 6.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9720 5.7620 7.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1820 4.3590 5.8370 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.1430 4.0570 5.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 -0.1140 2.7710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 1.9800 -0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5890 1.6010 -1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7630 1.8580 0.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9090 -0.9810 -3.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 -1.4010 -4.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0970 -1.6050 -4.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0110 -0.7530 0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7500 -1.2830 -0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1530 1.0960 4.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5630 1.5160 4.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 3.1750 2.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 2.9940 3.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3350 -0.8400 3.4240 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 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 17 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 9 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 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 29 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 2 0 0 0 0 29 30 1 0 0 0 0 31 44 1 0 0 0 0 M CHG 1 29 1 M END