IFLAB-ZINC04315275 MOE2007 3D Structure written by MMmdl. 45 48 0 0 0 0 0 0 0 0999 V2000 -0.6660 6.0170 0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 5.9940 0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4240 4.7910 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 3.6330 0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 3.6540 0.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4200 4.8360 0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1080 2.3320 0.3670 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0630 2.0280 0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 1.5170 0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 0.0090 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0040 -0.5510 -0.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 -2.0740 -1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 -2.1450 1.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4280 -0.6240 1.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -4.1570 0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5440 -4.7220 -0.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2570 -5.6050 -1.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2610 -6.1800 -2.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5930 -5.8800 -2.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9100 -5.0060 -1.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8930 -4.4340 -0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3500 -3.3480 1.0250 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9810 -5.9100 -1.8220 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 6.9790 0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 6.9390 0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4880 4.7610 -0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 4.8430 0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 -0.2520 -0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0340 -0.2120 -0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7040 -0.1470 -1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -2.4500 -1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7050 -2.4420 -1.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 -2.5220 1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7380 -2.5700 2.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 -0.2710 2.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4220 -0.2880 1.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4350 -4.5200 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5390 -4.4740 1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -6.8630 -3.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3840 -6.3270 -2.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9550 -4.7780 -0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0080 2.3010 -0.0230 N 0 3 0 0 0 0 0 0 0 0 0 0 1.9500 1.9680 -0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3250 -2.6320 0.3160 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.2750 -2.3120 0.5600 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 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 27 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 14 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 13 44 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 44 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 23 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 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 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