OTAVA-ZINC06147918 MOE2007 3D Structure written by MMmdl. 48 51 0 0 0 0 0 0 0 0999 V2000 0.5990 6.1360 0.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 4.7670 0.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 3.8820 -0.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 4.3950 -1.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 5.7650 -1.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 6.6280 -0.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 8.3160 -1.1660 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 3.3610 -3.1240 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 2.4430 -0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 1.6340 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2850 2.1380 0.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 0.1930 0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1270 -0.6320 0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 -2.0060 0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3270 -2.5380 0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 -1.7210 0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 -0.3420 0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 0.4430 0.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2540 1.8140 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6040 2.4660 -0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4630 2.0340 0.6960 F 0 0 0 0 0 0 0 0 0 0 0 0 4.1690 2.1460 -1.4600 F 0 0 0 0 0 0 0 0 0 0 0 0 3.5950 3.8170 -0.1860 F 0 0 0 0 0 0 0 0 0 0 0 0 2.8460 -2.3250 0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0900 -2.9220 2.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2050 -4.1120 3.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3530 -4.9060 3.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2730 -5.4420 2.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2060 -4.3250 1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5160 -3.8880 0.6770 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 6.8100 1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 4.4000 1.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7510 6.1570 -2.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 -0.2100 0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8400 -2.6350 0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0230 -2.7610 -0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6350 -1.5930 0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9720 -2.2760 2.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1830 -2.3450 3.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3070 -4.7400 3.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3200 -3.7550 4.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -6.1050 2.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1680 -6.0500 1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0690 -4.7320 0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0990 -3.6920 1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3560 -4.3230 0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0240 -3.4310 1.3890 N 0 3 0 0 0 0 0 0 0 0 0 0 2.1530 -3.9930 1.2870 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 9 10 1 0 0 0 0 9 19 2 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 42 1 0 0 0 0 28 43 1 0 0 0 0 29 44 1 0 0 0 0 29 45 1 0 0 0 0 29 47 1 0 0 0 0 30 46 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 47 1 M END