PUBCHEM-ZINC06095862 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3790 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 1.2040 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0340 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4290 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0940 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6960 -0.6850 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7150 -1.9000 -0.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8520 0.0080 -0.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8360 0.9780 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1320 -0.7040 -0.0590 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0350 -1.6130 -0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2070 0.1940 -0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8780 0.4530 -2.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0980 1.5420 -2.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7940 1.7810 -3.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2720 0.9290 -4.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0540 -0.1620 -4.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3600 -0.3950 -3.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5650 -1.0740 -5.4770 N 0 3 0 0 0 0 0 0 0 0 0 0 8.2510 -2.0320 -5.1690 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2990 -0.8660 -6.6480 O 0 5 0 0 0 0 0 0 0 0 0 0 6.5240 -1.0630 1.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8070 -0.7560 2.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.7600 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9880 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 3.1730 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2430 1.1400 -0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1760 -0.3000 -0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7260 2.2040 -1.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1850 2.6310 -4.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9720 -1.2410 -2.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9750 1.1620 -6.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6690 -1.7250 1.5810 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8780 -1.9330 2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6150 1.7260 -6.5390 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 23 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 34 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 23 24 2 0 0 0 0 23 36 1 0 0 0 0 35 38 1 0 0 0 0 36 37 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END