PUBCHEM-ZINC05804380 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.8010 1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -0.5040 2.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -1.5200 3.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -2.8510 3.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -3.1660 1.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -2.1440 0.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -2.1290 -0.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.7890 -1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.4870 -2.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 0.6700 -2.9010 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -1.5090 -3.3980 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -2.7940 -2.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -3.0900 -1.6940 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 -1.2300 -4.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3840 -1.1130 -5.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3590 -0.8210 -6.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 -0.7100 -7.3580 N 0 3 0 0 0 0 0 0 0 0 0 0 3.4710 -1.7240 -7.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6710 -1.2320 -8.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6440 0.1110 -7.9270 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3650 0.7420 -8.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4260 0.3940 -7.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -3.8440 3.9400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 -3.4480 5.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 0.5250 2.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -1.2820 4.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -4.1990 1.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -3.5940 -3.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 -2.0410 -5.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 -0.2940 -5.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8940 -0.3020 -4.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9130 -2.0490 -5.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 -1.6320 -7.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 0.1150 -7.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1580 -2.7550 -7.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4960 -1.7890 -8.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0850 1.3700 -7.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -4.3340 5.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 -2.8410 5.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 -2.8660 5.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 10 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 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 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 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 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 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 M CHG 1 19 1 M END