PUBCHEM-ZINC06146553 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 -1.6050 -2.3530 4.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 -1.5250 3.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6600 -2.4270 2.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6810 -3.6270 2.6330 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2050 -1.9000 1.3410 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1300 -0.9490 1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9100 -2.7650 0.3920 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3360 -3.6780 0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0720 -2.0430 -0.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5660 -2.5640 -2.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8870 -3.8760 -1.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1910 -4.8530 -2.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5530 -6.0760 -2.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6160 -6.3350 -1.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3110 -5.3710 -0.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 -4.1410 -1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2690 -3.1140 0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8820 -2.2540 1.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1080 -2.5410 2.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7690 -3.7190 1.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0380 -4.0480 2.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6210 -5.2100 2.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9580 -6.0300 1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7760 -5.7200 0.6890 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1520 -4.5980 1.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8820 -4.2660 0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7430 -1.6140 3.3320 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.6290 -0.4110 3.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3800 -2.0560 4.2720 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.1460 -1.7000 5.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4820 -2.8340 5.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 -3.1130 4.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7430 -0.7640 3.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 -1.0430 3.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6000 -1.1020 -0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6500 -2.0290 -2.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9230 -4.6520 -3.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7870 -6.8330 -3.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 -7.2940 -1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 -5.5790 -0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6940 -3.3880 -0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3760 -1.3480 2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5370 -3.4000 3.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5940 -5.4920 2.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4300 -6.9460 0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2720 -5.0900 -0.3490 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7120 -5.7650 0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 17 1 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 26 2 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 27 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END