IBS-ZINC04122107 MOE2007 3D Structure written by MMmdl. 26 27 0 0 0 0 0 0 0 0999 V2000 0.0450 -6.0360 -3.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -4.6070 -3.7890 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -3.9940 -2.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -4.7610 -1.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -4.1570 -0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.7650 -0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0740 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -2.6960 2.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -0.6540 1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6380 -1.1760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -1.9830 -1.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -2.6100 -2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -1.8050 -3.7520 N 0 3 0 0 0 0 0 0 0 0 0 0 1.0340 -1.4600 -4.2730 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0750 -1.4880 -4.2520 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 1.9870 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 1.9660 -1.1230 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 1.9540 1.1610 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.8350 -6.4120 -3.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -6.3970 -4.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -6.3890 -3.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -5.8380 -1.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -4.7560 0.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.0990 2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 13 2 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 12 2 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END