PUBCHEM-ZINC05457054 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 1 0 0 0 0 0999 V2000 1.1760 0.2730 -0.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 0.4410 0.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1090 0.1490 0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 -0.4730 1.5660 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8980 -1.4970 1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4090 -0.1980 1.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8060 0.9960 1.7950 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -0.4440 2.7690 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 0.7990 3.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7270 -1.5890 3.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 -2.6740 2.5230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7620 -1.5370 4.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9920 -2.6630 4.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9530 -2.7040 5.8710 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6960 -1.5920 6.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7030 -1.5660 6.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4940 -0.4330 7.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2770 0.6950 6.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2690 0.6810 5.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4730 -0.4420 5.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5100 -0.4160 4.2940 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 -0.7630 -1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 0.9130 -1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 0.5490 -0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4360 1.4920 0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -0.9020 -0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7570 0.3770 0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4560 0.7640 -0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 1.4430 3.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 0.6000 4.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 1.3200 3.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4150 -3.5730 4.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8760 -2.4490 7.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2760 -0.4350 7.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8880 1.5830 6.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1000 1.5640 4.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0610 -1.2090 2.3260 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 9 31 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 21 2 0 0 0 0 13 14 2 0 0 0 0 13 32 1 0 0 0 0 14 15 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 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 M CHG 1 37 -1 M END