PUBCHEM-ZINC03040435 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6070 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 0.1610 -2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 -0.4550 -3.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 -1.8350 -3.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 -2.6020 -2.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -1.9910 -1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -2.8130 -0.0470 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1250 -4.0280 -0.1080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 -2.2740 0.9020 O 0 5 0 0 0 0 0 0 0 0 0 0 2.5040 -2.5030 -4.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9870 -2.7160 -4.0700 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4410 -1.7640 -3.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6810 -3.2720 -5.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2320 -4.3460 -5.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1210 -3.6600 -2.9570 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7120 -3.2940 -1.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8470 -4.2430 -0.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4840 -3.8520 0.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6070 -4.7450 1.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1020 -6.0300 1.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4700 -6.4290 0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3320 -5.5420 -0.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 -5.9320 -1.9970 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 1.2390 -2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 0.1430 -3.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -3.6800 -2.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 -3.4670 -4.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 -1.8720 -5.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1060 -2.2920 -1.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8800 -2.8520 0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1000 -4.4420 2.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2040 -6.7230 2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0800 -7.4320 0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2960 -6.3220 -2.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6880 -2.5740 -6.4330 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1460 -2.9710 -7.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 17 1 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 22 23 2 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 25 39 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 9 1 M CHG 1 11 -1 M END