PUBCHEM-ZINC05909655 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 0 0 0 0 0 0999 V2000 0.9890 -2.5060 -0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 -3.8450 0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 -3.8220 0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 -4.2080 -0.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4950 -4.0450 -0.4570 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.1750 -3.4480 1.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8230 -3.3830 1.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2340 -2.9150 2.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 -1.7360 2.7390 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9750 -3.7920 3.5810 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -3.2580 4.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1460 -3.0840 2.0250 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4510 -3.1920 1.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7750 -3.6100 0.6080 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4770 -2.8070 2.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7750 -2.7850 2.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1430 -2.9090 0.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2020 -3.7380 0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5410 -3.8490 -0.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8340 -3.1430 -1.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7840 -2.3200 -1.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4380 -2.1940 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2040 -3.2680 -3.2100 N 0 3 0 0 0 0 0 0 0 0 0 0 -10.1270 -3.9910 -3.5400 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5840 -2.6480 -4.0560 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.2430 -4.7170 -2.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 -2.5230 -0.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 -2.3400 -1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 -1.7020 0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 -4.6490 -0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8330 -4.0120 1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0630 -2.5180 5.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2340 -4.0670 5.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5660 -2.7890 4.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8870 -2.7510 2.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1940 -2.5410 3.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5450 -2.6760 3.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7540 -4.2900 1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3590 -4.4880 -1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2370 -1.7730 -2.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6210 -1.5480 0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 -5.7990 -2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9350 -4.4670 -2.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 -4.2530 -2.3340 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 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 2 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END