PUBCHEM-ZINC05615450 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 3.1570 3.9720 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9600 3.5710 1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7890 4.7930 0.7300 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3440 5.7080 1.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7600 4.8060 -0.8090 C 0 0 3 0 0 0 0 0 0 0 0 0 6.7720 4.7160 -1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9100 3.5920 -1.2460 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5510 2.7380 -1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1090 3.9210 -2.3830 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1440 6.0450 -1.2890 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1120 6.2670 -2.3900 N 0 3 0 0 0 0 0 0 0 0 0 0 5.0810 6.4890 -3.4920 N 0 5 0 0 0 0 0 0 0 0 0 0 7.2300 4.6580 1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2510 4.7330 2.6530 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 4.3860 3.8060 2.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6090 2.7130 1.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6200 4.1150 -3.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6360 3.6990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8340 5.4650 0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1340 4.6550 3.0380 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 20 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 29 1 0 0 0 0 20 21 2 0 0 0 0 21 22 2 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 21 1 M CHG 1 22 -1 M END