IBS-ZINC00499606 MOE2007 3D Structure written by MMmdl. 39 42 0 0 0 0 0 0 0 0999 V2000 1.1640 0.3460 -3.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 0.4160 -2.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4260 0.5150 -0.8120 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0730 1.6840 -0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 3.0300 -0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 3.9470 0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 3.5300 1.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 2.1730 1.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 1.2760 1.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 -0.5210 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 -1.8080 -0.4380 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 -2.6970 -0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 -2.4570 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9180 -1.4520 -0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1610 -1.5920 0.1520 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9550 -0.9920 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1820 -2.6760 0.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 -3.2510 0.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6710 -4.4020 1.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7040 -4.9290 2.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9610 -4.3290 2.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2260 -3.1900 1.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 1.2370 -3.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7060 0.2740 -4.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 -0.5260 -3.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7950 1.2830 -2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7760 -0.4710 -2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7360 3.3460 -1.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 5.0140 0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 4.2830 2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 1.8390 2.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 -3.7540 -0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7330 -0.6590 -1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6970 -4.8820 1.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5240 -5.8160 3.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7510 -4.7540 3.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2090 -2.7310 1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 -0.0980 1.0290 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0650 -0.7040 1.7510 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 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 38 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 21 2 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 22 37 1 0 0 0 0 38 39 1 0 0 0 0 M CHG 1 38 1 M END