PUBCHEM-ZINC05798960 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 1 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 0.0230 -0.7120 1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0980 1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.7220 -0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0160 -1.2090 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6970 -1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.7140 -2.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4270 -2.9780 -2.9310 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9510 -3.5180 -2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 -3.8150 -4.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7730 -4.1600 -4.5540 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9530 -4.9090 -5.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2320 -5.2780 -6.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4150 -6.0390 -7.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3180 -6.4340 -7.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0380 -6.0630 -7.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8570 -5.2980 -6.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5020 -7.2050 -9.1090 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3970 -7.4640 -9.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7360 -7.4800 -9.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0860 -1.7330 -3.1750 O 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 0.0250 -0.1980 2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6810 2.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -3.8010 -0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.1530 -2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 -2.0980 -3.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -3.6630 -2.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9840 -3.2400 -5.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 -4.7250 -4.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0840 -4.9710 -5.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4110 -6.3270 -7.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1840 -6.3700 -8.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 -5.0060 -6.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6720 -1.1980 -3.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 22 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 22 38 1 0 0 0 0 M CHG 1 6 1 M END