PUBCHEM-ZINC04772521 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 1 0 0 0 0 0999 V2000 -0.0650 1.5760 0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 0.0650 0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3150 -0.4490 0.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4680 -1.8050 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 -2.7410 -0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7200 -4.1070 -0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9670 -4.6220 -0.2140 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9340 -3.6960 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7730 -2.3230 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0020 -1.7240 0.1230 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9300 -2.6760 0.0890 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2940 -3.8730 -0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0210 -5.1320 -0.0680 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.3400 -5.8660 -0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6410 -5.6970 1.2320 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.8840 -6.7490 1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9780 -4.9530 1.2500 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.8830 -3.9240 1.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3690 -4.9240 -0.2240 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.8640 -3.9800 -0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1370 -4.9760 -0.9960 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2490 -6.0890 -0.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5190 -5.9650 -2.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6630 -5.7050 -2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9080 -5.6290 2.0880 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3540 -5.8510 2.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9580 -5.4310 2.3320 O 0 5 0 0 0 0 0 0 0 0 0 0 0.3170 -5.0120 -0.3550 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 2.0210 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 2.0010 -0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 1.8580 1.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 -0.1890 -0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5830 -0.3350 0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -2.4300 -0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7490 -7.0510 -0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2070 -6.1000 -0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 -4.7430 -0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -5.9810 -0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 27 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 25 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 28 37 1 0 0 0 0 28 38 1 0 0 0 0 M CHG 1 27 -1 M END