CHEMBRIDGE-ZINC03997270 MOE2007 3D Structure written by MMmdl. 42 45 0 0 0 0 0 0 0 0999 V2000 -9.3560 -0.6050 1.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2780 0.6340 2.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1200 1.3770 2.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0220 0.8760 1.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1100 -0.3740 0.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2730 -1.1080 1.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7810 1.6630 1.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7240 1.1770 0.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4910 1.9590 0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4190 3.0480 1.2410 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4350 1.4730 0.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2330 2.1700 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2310 3.5660 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 4.2610 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 3.5870 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 2.1980 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 1.4780 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 0.0040 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 -0.6280 0.2660 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 -0.6980 -0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 -2.0580 -0.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4600 -2.6980 -0.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6510 -1.9940 -0.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6680 -0.6400 -0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4800 0.0190 -0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4790 1.4660 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 2.0460 0.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.2660 -1.1820 1.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1270 1.0190 2.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0600 2.3430 2.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2670 -0.7650 0.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3410 -2.0750 0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7180 2.6300 1.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7880 0.2100 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5130 0.6360 -0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1680 4.1040 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 5.3410 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0980 4.1420 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 -2.6140 -0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4600 -3.7540 -1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5730 -2.5040 -1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6010 -0.0950 -0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 26 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 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 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 M END