PUBCHEM-ZINC04545921 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 36 0 0 1 0 0 0 0 0999 V2000 -0.8900 0.2820 0.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 0.0850 0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1210 -1.0370 1.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8790 -0.2060 -1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 -0.2690 -1.4560 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9340 -0.9520 -0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3320 -0.8260 -2.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3440 0.0700 -3.8120 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9970 1.0550 -1.4200 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6610 1.5870 -0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8060 1.0210 0.7370 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1990 2.9770 -0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9800 3.5470 0.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5490 4.9300 0.2860 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1400 4.9530 -0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4200 5.4960 1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9810 6.6690 1.7230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 1.1090 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4540 -0.6200 0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0970 0.5190 1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 1.0190 0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 -1.9980 1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2070 -1.1460 1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 -0.8280 2.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 -1.1510 -1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3800 0.5690 -1.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9260 1.5500 -2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8480 2.9220 -1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3470 3.6210 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3380 3.5760 1.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8000 2.8600 0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3110 -2.0830 -3.0150 O 0 5 0 0 0 0 0 0 0 0 0 0 7.3480 4.7970 1.8980 O 0 5 0 0 0 0 0 0 0 0 0 0 4.4260 5.9310 0.0910 N 0 3 0 0 0 0 0 0 0 0 0 0 4.7920 6.7070 0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5270 5.6390 0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3390 6.2940 -0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 21 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 34 1 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 34 37 1 0 0 0 0 M CHG 1 32 -1 M CHG 1 33 -1 M CHG 1 34 1 M END