SPECS-ZINC00338409 MOE2007 3D Structure written by MMmdl. 36 38 0 0 0 0 0 0 0 0999 V2000 0.1370 1.8600 9.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 0.8630 8.8280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 1.1030 7.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 0.6770 7.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2440 0.9280 6.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4730 1.5960 5.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 2.0230 5.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 1.7720 6.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5950 2.1860 6.9490 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0220 1.8630 3.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2460 2.4300 3.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7770 2.6870 2.3590 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 2.4100 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7560 2.7020 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1050 2.4130 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 1.8300 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 1.5320 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8710 1.8260 1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 1.5190 2.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 1.0080 2.5750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 0.9630 0.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 2.7020 -2.3870 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5350 -0.0300 8.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 -0.2460 9.3800 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 1.9950 9.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3070 2.8020 9.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 1.5450 10.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2430 0.6020 5.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 2.5460 4.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6360 3.0780 7.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8130 2.6830 4.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7360 3.1540 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3450 1.6100 -2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5100 3.5880 -2.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5340 -0.3580 8.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 22 1 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 21 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 21 34 1 0 0 0 0 22 35 1 0 0 0 0 23 24 2 0 0 0 0 23 36 1 0 0 0 0 M END