PUBCHEM-ZINC04773245 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3770 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 1.2080 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.0220 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3870 1.4030 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 3.4830 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4020 3.9950 1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 5.5170 1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6840 6.1330 1.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4720 5.5470 -0.1450 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9790 5.8100 -1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5270 4.0240 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7990 6.0760 -0.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -2.1610 -0.0200 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1760 -2.7810 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 -2.7580 -0.0330 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 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 3.3390 -0.5090 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3180 1.9520 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 3.5520 1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 3.7330 2.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2450 5.7790 0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 5.8980 1.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6050 7.2140 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1980 5.9040 1.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0330 3.7620 0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0750 3.6020 -0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8400 7.0390 -0.2230 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 18 1 0 0 0 0 2 3 2 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 15 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END