PUBCHEM-ZINC06112744 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3830 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -0.6890 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 0.0100 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.4140 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 2.0930 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7860 1.8490 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4260 3.0850 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8170 3.1160 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5240 1.9870 -0.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9570 0.8040 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5670 0.6790 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7200 -0.4070 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0070 -1.3330 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5200 4.4170 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8820 5.4520 -0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8670 4.4560 -0.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5620 5.7460 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0740 5.5090 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8000 6.8560 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2480 6.6300 -0.0800 N 0 3 0 0 0 0 0 0 0 0 0 0 13.0050 6.5150 -1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2780 6.3160 -0.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2790 6.3120 0.5760 N 0 0 0 0 0 0 0 0 0 0 0 0 15.0500 6.1900 1.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0050 6.5140 0.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9080 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.5520 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -1.7690 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 3.1720 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8550 4.0010 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5730 -0.0830 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3760 3.6300 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2740 6.3140 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2910 6.3050 0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3620 4.9410 0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3450 4.9500 -0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5120 7.4240 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5290 7.4150 0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6540 6.5730 -2.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1350 6.1840 -1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6680 6.5680 2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 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 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 42 1 0 0 0 0 M CHG 1 21 1 M END