COMGENEX-ZINC06837615 MOE2007 3D Structure written by MMmdl. 44 46 0 0 1 0 0 0 0 0999 V2000 -0.4550 -0.2010 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 1.3000 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7670 1.9490 1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0760 2.4690 1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6270 3.0770 2.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 3.1750 3.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5860 2.6490 3.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 2.0600 2.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 1.6650 2.7340 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8560 1.2100 2.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 1.9750 4.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 2.5730 4.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 3.0860 6.0220 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7950 3.3330 6.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 4.3350 6.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 5.5840 5.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 5.7170 5.7560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5650 1.8840 6.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8190 1.6770 7.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0600 0.5630 8.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0490 -0.3680 8.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 -0.1760 7.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 0.9340 7.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 -1.4920 9.3460 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 -1.7100 9.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5260 -0.4280 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -0.6470 -0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -0.6860 0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 1.4980 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6590 1.7540 -0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6770 2.4070 0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6330 3.4850 2.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3230 3.6720 4.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4900 1.7410 4.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 4.5400 7.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1380 4.2030 5.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6330 2.3790 7.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0500 0.4570 8.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 -0.8950 8.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4260 1.0550 6.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2040 -1.8540 9.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6400 -0.8950 10.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 -2.6300 10.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 6.3560 5.1030 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 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 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 18 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 M CHG 1 44 -1 M END