COMGENEX-ZINC04796441 MOE2007 3D Structure written by MMmdl. 44 45 0 0 0 0 0 0 0 0999 V2000 3.7140 1.5540 1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 1.2340 1.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5650 2.0700 2.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 1.4670 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 1.1040 -1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9670 0.6540 -1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3100 -0.6890 -1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6380 -1.1100 -1.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6340 -0.1920 -1.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3060 1.1370 -0.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9780 1.5600 -0.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9190 -0.6500 -0.9010 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0750 -0.1760 -1.9630 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.3110 -0.8510 -1.6130 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0460 1.2690 -2.1000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5450 -0.8720 -3.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9560 -0.0510 -4.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5500 -0.6110 -5.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7450 -1.9710 -5.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3440 -2.7870 -4.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7500 -2.2370 -3.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3530 -2.5040 -7.0850 F 0 0 0 0 0 0 0 0 0 0 0 0 3.8830 2.6050 1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2010 1.3580 2.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2080 0.9350 0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1150 0.1750 1.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 1.7760 2.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0910 1.9360 3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5840 3.1370 2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0890 0.8810 -0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5860 2.5260 -0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 2.1450 -1.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 0.4790 -2.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5500 -1.4220 -1.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8900 -2.1540 -1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0730 1.8510 -0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7480 2.6070 -0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8100 1.0120 -4.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0910 0.0020 -6.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4940 -3.8420 -5.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2230 -2.8710 -3.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 1.0210 -0.0020 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.3950 1.5800 0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 0.0500 0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 M CHG 1 42 1 M END