PUBCHEM-ZINC02014486 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3980 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 1.3010 -0.3870 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 0.7060 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3040 1.8090 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 3.1520 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0410 3.4050 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4930 4.7320 -0.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8150 4.9930 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6140 4.0810 -0.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3000 6.4200 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2820 7.7930 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8110 7.7550 0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8190 5.8580 -1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2900 5.8960 -1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8010 7.2310 -1.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3020 6.9000 -2.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9030 7.9340 -3.3190 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8060 -1.8500 -0.0250 N 0 3 0 0 0 0 0 0 0 0 0 0 1.0070 -2.7700 -0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0010 -2.0810 -0.0370 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8910 2.0320 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 -0.6570 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0490 3.9640 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8540 5.4610 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9220 6.9340 -0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9390 6.9250 0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8920 8.1670 1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9650 8.4510 -0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1950 8.7640 0.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1280 7.1190 1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1360 5.2000 -0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2090 5.4840 -2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9730 6.5320 -2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9060 4.8870 -1.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1800 6.4900 -0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1560 8.2210 -0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3890 6.8260 -2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8750 5.9510 -2.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1870 7.7890 -4.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7690 6.4370 -0.0290 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3320 7.2140 -0.9950 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 12 41 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 14 42 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END