PUBCHEM-ZINC05529143 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 0 0 1 0 0 0 0 0999 V2000 0.4660 1.3250 -0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -0.1290 0.0070 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4530 -0.7070 -0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 -0.6260 1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -2.1240 1.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 -2.4790 1.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 -1.9220 0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3370 -0.4740 0.1410 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3550 0.4830 0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 1.6970 0.2130 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7770 -0.0520 0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8320 1.0520 0.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2320 0.4590 0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3780 1.4710 0.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0630 2.6900 0.5920 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5430 1.4110 -0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 1.6940 -1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 1.9840 0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9180 -0.4340 1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4900 -0.0770 2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 -2.6850 0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 -2.4330 2.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9910 -3.5670 1.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 -2.0640 2.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 -2.3820 -0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6250 -2.1840 0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9870 -0.6830 -0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8370 -0.6610 1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6270 1.7050 1.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7730 1.6840 -0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4300 -0.1910 -0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2830 -0.1690 1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5220 0.9400 0.7410 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 23 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 M CHG 1 33 -1 M END