PUBCHEM-ZINC00237472 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 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 0.0230 -0.7010 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0840 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7730 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0760 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6870 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 0.0730 -2.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -3.6110 -2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -4.2920 -3.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 -4.2550 -3.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 -3.5750 -2.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -5.8260 -5.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1430 -6.8190 -5.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3860 -6.4460 -5.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4260 -7.3570 -5.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2220 -8.6420 -5.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9800 -9.0150 -4.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9390 -8.1050 -4.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7620 -10.3900 -4.3780 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.6780 -11.1920 -4.3840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6670 -10.7190 -3.9590 O 0 5 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 -0.1640 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6250 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -3.8530 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 0.2700 -2.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 -0.5190 -3.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 1.0180 -2.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 -4.3700 -1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 -2.9920 -2.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 -3.5330 -4.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 -4.9380 -4.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 -4.8750 -4.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 -3.4960 -4.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0790 -2.9280 -2.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 -4.3330 -1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 -6.3530 -5.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 -5.1220 -6.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5450 -5.4430 -6.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3970 -7.0660 -6.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0350 -9.3530 -5.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -8.3970 -4.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -5.0960 -4.0590 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.7710 -2.4170 N 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 47 1 0 0 0 0 7 8 1 0 0 0 0 8 29 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 32 1 0 0 0 0 9 33 1 0 0 0 0 9 47 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 11 46 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 12 47 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END