PUBCHEM-ZINC05594683 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 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 1.1480 -0.6770 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 0.0500 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 1.4530 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 2.0380 0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5760 1.8990 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3850 0.8020 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 -0.2820 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0120 3.2980 -0.0180 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1500 3.9650 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9180 3.5840 -1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0150 4.5460 -0.7470 C 0 0 3 0 0 0 0 0 0 0 0 0 6.9960 4.0860 -0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7380 4.8120 0.7470 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1560 5.7250 0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9150 3.5810 1.2080 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3130 3.8230 2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7740 2.4700 1.4720 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9950 4.9010 1.4940 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9830 5.1750 2.5840 N 0 3 0 0 0 0 0 0 0 0 0 0 6.9710 5.4490 3.6740 N 0 5 0 0 0 0 0 0 0 0 0 0 5.9500 5.8560 -1.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2910 5.6100 -2.9000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 -2.0600 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 1.8230 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4640 0.8280 -0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3660 2.6570 -1.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3380 4.0500 -2.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3600 2.5970 2.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9390 6.2630 -1.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6520 6.5720 -1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2700 6.3980 -3.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3200 -2.5510 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -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 8 27 1 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 28 1 0 0 0 0 12 29 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 30 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 31 1 0 0 0 0 23 32 1 0 0 0 0 24 33 1 0 0 0 0 25 34 1 0 0 0 0 25 35 1 0 0 0 0 M CHG 1 21 1 M CHG 1 22 -1 M END