PUBCHEM-ZINC05138026 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -7.1530 -4.8970 -5.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4090 -5.0680 -4.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7380 -6.0710 -4.3970 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6020 -3.9890 -3.7650 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0630 -3.7990 -2.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4200 -2.6210 -1.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9300 -2.3530 -0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0800 -3.2650 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7010 -4.4530 -0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2060 -4.7070 -1.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8690 -5.3540 0.1430 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6950 -6.7510 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4830 -7.3080 0.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2440 -8.6850 0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2130 -9.5520 -0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9890 -10.9380 -0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9770 -11.7730 -0.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1880 -11.2500 -1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4170 -9.8740 -1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4410 -9.0110 -0.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6600 -7.6200 -0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6940 -13.5530 -0.8800 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.5730 -14.0880 0.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1000 -13.8240 -2.2570 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9590 -5.7530 -6.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2280 -4.8360 -5.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8190 -3.9850 -6.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2000 -3.2450 -4.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0830 -1.8950 -2.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2150 -1.4380 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7210 -3.0450 1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8890 -5.6100 -2.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2810 -4.9160 0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6990 -6.6700 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 -9.0740 0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0490 -11.3680 0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9460 -11.9080 -1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3650 -9.4790 -1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6190 -7.2210 -0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2630 -13.6940 -0.6170 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 21 2 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 40 1 0 0 0 0 M CHG 1 40 -1 M END