PUBCHEM-ZINC05976557 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 0.4130 0.0740 1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -0.7560 -0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 -2.2460 0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3950 -0.5930 -0.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7930 -0.2430 -1.2840 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1480 -0.2500 -1.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 -0.6240 -0.4580 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 0.2220 -2.5620 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9150 0.2960 -3.0520 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5720 0.5110 -2.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3360 -0.9960 -3.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5070 -2.1840 -2.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5330 -3.1780 -2.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7190 -4.2650 -1.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 -5.2810 -1.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9720 -6.3480 -0.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1490 -6.4050 -0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1040 -5.3930 -0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9140 -4.3170 -1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8640 -3.3710 -1.2370 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6410 -2.3310 -2.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0800 1.4010 -4.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9990 1.7550 -4.6930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4480 -0.0580 1.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 1.1430 0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2340 -0.2060 1.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 -2.6750 0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2430 -2.8070 -0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4270 -2.4190 0.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 0.4580 -0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6530 -1.1440 -1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0360 -0.9500 0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 0.5740 -3.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6040 -1.2450 -4.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2860 -0.8530 -4.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6210 -3.0990 -3.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8300 -5.2430 -2.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2250 -7.1310 -0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3290 -7.2320 0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0230 -5.4410 0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4360 -1.5900 -2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2620 1.8070 -4.3150 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 22 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 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 36 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 M CHG 1 42 -1 M END