PUBCHEM-ZINC05615455 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 36 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3170 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 -0.6780 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3540 0.0490 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2790 1.4530 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 2.0380 0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5710 1.9010 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3900 0.7620 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6540 -0.2940 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0130 3.2980 -0.0180 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1490 3.9620 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9150 3.5620 1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2860 4.0000 0.6450 C 0 0 3 0 0 0 0 0 0 0 0 0 6.9610 3.1470 0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9670 4.5520 -0.7660 C 0 0 3 0 0 0 0 0 0 0 0 0 6.8460 4.5040 -1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8660 3.5850 -1.2710 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3110 2.6640 -1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0540 4.2260 -2.3080 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4960 4.4300 -3.3220 N 0 3 0 0 0 0 0 0 0 0 0 0 4.9380 4.6340 -4.3350 N 0 5 0 0 0 0 0 0 0 0 0 0 5.4720 5.8900 -0.6880 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8950 5.0940 1.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2080 4.5530 2.8100 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 -2.0590 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 1.8240 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4900 4.3560 1.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0240 2.6520 1.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2560 6.2810 -1.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8050 5.4720 1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1800 5.9090 1.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5980 5.1920 3.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3150 -2.5480 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9950 -2.5400 -0.0300 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 26 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 23 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 22 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 2 0 0 0 0 22 29 1 0 0 0 0 23 24 1 0 0 0 0 23 30 1 0 0 0 0 23 31 1 0 0 0 0 24 32 1 0 0 0 0 25 33 1 0 0 0 0 25 34 1 0 0 0 0 M CHG 1 20 1 M CHG 1 21 -1 M END