PUBCHEM-ZINC02020644 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 32 0 0 1 0 0 0 0 0999 V2000 0.2390 1.6720 0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 0.1470 0.0350 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9870 -0.0840 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 -0.5140 1.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -0.2510 2.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 -0.0770 2.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -0.4370 -1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -0.5170 -3.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 -0.0100 -4.9300 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2220 -0.2340 -4.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 1.5070 -5.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3290 -0.7510 -6.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 -0.5690 -7.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7680 -0.3810 -7.2230 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 1.9660 0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 2.1680 -0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 2.0690 1.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7030 -1.6050 1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7460 -0.2030 1.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8110 -0.1570 -1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 -1.5290 -1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 -1.6050 -3.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6870 -0.2370 -3.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 1.8460 -6.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 2.0560 -4.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 1.7980 -5.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 -0.4510 -6.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 -1.8310 -5.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -0.2550 3.6170 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0840 0.0670 -2.4540 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.9240 -0.1330 -2.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 1.0890 -2.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -0.6430 -8.5220 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 4 5 1 0 0 0 0 4 18 1 0 0 0 0 4 19 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 7 20 1 0 0 0 0 7 21 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 M CHG 1 29 -1 M CHG 1 30 1 M CHG 1 33 -1 M END