CHEMDIV-ZINC06877816 MOE2007 3D Structure written by MMmdl. 45 48 0 0 0 0 0 0 0 0999 V2000 6.9480 10.8460 -0.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9990 9.6960 -0.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2610 8.6860 0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3940 7.5990 0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2550 7.4940 -0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0030 8.5020 -1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8710 9.5900 -1.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3150 6.3270 -0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1440 6.5640 1.2280 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 5.0710 1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 2.9190 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7710 1.5460 1.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4050 0.8950 0.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4630 1.6200 0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4710 2.9630 0.2120 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3060 3.5730 0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 4.9200 0.5510 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8970 5.9580 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 6.4750 -1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 7.8490 -1.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 8.3360 -2.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 7.4530 -3.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 6.0930 -3.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 5.6040 -2.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 7.9210 -4.9420 F 0 0 0 0 0 0 0 0 0 0 0 0 7.7140 10.5980 -1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4180 11.7480 -1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4380 11.0850 0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1450 8.7430 1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6180 6.8330 1.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1320 8.4480 -1.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6610 10.3550 -2.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8920 5.4120 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7580 6.1750 -1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6070 1.0220 1.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 -0.1820 1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3700 1.1050 0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 5.5660 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 6.7550 0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 8.5540 -0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 9.3970 -2.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 5.4220 -4.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4560 4.5390 -2.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7170 3.8980 1.4530 N 0 3 0 0 0 0 0 0 0 0 0 0 2.6230 3.7700 1.8920 H 0 0 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 10 17 1 0 0 0 0 10 44 2 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 11 44 1 0 0 0 0 12 13 2 0 0 0 0 12 35 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 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 44 1 M END