PUBCHEM-ZINC00511861 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 -0.0130 1.5230 0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -0.0060 0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -0.4680 -0.9840 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6550 -0.0170 -1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 -0.0400 -2.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 -1.9690 -0.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0490 -2.5530 -1.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1740 -3.9280 -1.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 -4.7250 -0.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2110 -4.1370 -0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3290 -2.7610 -0.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 -6.0790 -0.9490 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7840 -6.6320 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1240 -5.9360 1.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 -8.0840 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 -8.9930 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 -10.3480 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5550 -10.8070 0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5960 -9.9120 0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3530 -8.5540 0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -7.5970 0.5050 N 0 3 0 0 0 0 0 0 0 0 0 0 5.5780 -8.0040 0.7990 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2760 -6.4030 0.3580 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0080 1.9020 0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 1.9040 -0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4820 1.8520 1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 -0.3880 1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 -0.3860 0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1840 -0.4910 -2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 1.0460 -2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 -0.3680 -3.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9300 -1.9320 -1.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 -4.3830 -1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0930 -4.7550 -0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3040 -2.3030 -0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -8.6370 -0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4570 -11.0530 -0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7520 -11.8690 0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6010 -10.2760 0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END