PUBCHEM-ZINC04117907 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 29 0 0 0 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 2.3680 4.1960 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3530 5.5440 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 6.1390 0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6500 6.3120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3540 7.8130 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6510 8.5810 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7030 7.9880 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -2.1610 -0.0210 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1760 -2.7810 -0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 -2.7580 -0.0350 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 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3180 1.9520 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 3.9580 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2130 3.7210 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2330 6.0500 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2160 6.0600 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7710 8.0750 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 8.0660 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6360 9.9230 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4930 10.3720 0.0030 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 22 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 13 14 2 0 0 0 0 13 28 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 28 29 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END