IFLAB-ZINC04315389 MOE2007 3D Structure written by MMmdl. 45 48 0 0 1 0 0 0 0 0999 V2000 -1.2210 1.8750 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2120 3.2610 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 3.9780 0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 3.2320 0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 1.8620 -0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 1.1360 -0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4630 1.4770 -0.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7620 0.5180 -0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2670 2.5290 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7700 2.5270 -0.0340 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0370 3.5210 0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3950 1.4760 0.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9180 1.5160 0.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4340 1.3690 -0.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3060 2.3960 -1.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3580 2.4160 -2.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7820 2.8950 -3.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8240 1.9950 -3.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1450 2.4460 -3.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4430 3.7990 -3.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4110 4.7060 -2.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0880 4.2550 -2.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6960 6.3930 -2.6870 Cl 0 0 0 0 0 0 0 0 0 0 0 0 13.0960 4.2850 -3.2910 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.1770 1.3650 -0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1620 3.7880 0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 5.0410 0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 0.0730 -0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0620 1.6390 1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0440 0.4760 0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2750 2.4620 1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3310 0.7130 1.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5200 1.4970 -0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1660 0.3990 -1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0020 1.4510 -1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9460 3.2260 -2.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2350 1.3920 -3.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7200 3.0710 -3.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6260 0.9340 -3.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9410 1.7310 -3.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2950 4.9760 -2.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4770 3.5910 0.2000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.7980 4.5350 0.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8160 2.4460 -1.4710 N 0 3 0 0 0 0 0 0 0 0 0 0 7.1100 3.3520 -1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 42 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 14 44 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 44 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 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 41 1 0 0 0 0 42 43 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 42 1 M CHG 1 44 1 M END