PUBCHEM-ZINC00983409 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 33 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 1.1790 -0.6630 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -2.1240 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 -2.7180 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 -2.8770 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2340 -2.2250 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 -0.7560 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4060 -0.1180 0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4510 -0.7440 0.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6010 -0.0220 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2080 0.3540 -1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3780 1.0870 -1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9460 1.4470 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3440 1.0740 1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1760 0.3360 1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5360 -0.0680 2.5520 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.0410 0.2460 3.6150 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5040 -0.7150 2.5360 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.5250 -3.0020 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 -0.1110 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 -3.9570 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7650 0.0730 -2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8500 1.3800 -2.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8610 2.0200 0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7890 1.3570 2.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3060 -4.0690 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0930 -2.7530 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1090 -2.7440 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 15 2 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 30 1 0 0 0 0 20 31 1 0 0 0 0 20 32 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END