IBS-ZINC05460119 MOE2007 3D Structure written by MMmdl. 45 49 0 0 1 0 0 0 0 0999 V2000 0.1410 1.0440 -0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 1.7390 0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 3.0860 0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 3.7270 0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1940 3.0550 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0970 1.6940 -0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5130 3.7970 0.0750 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3440 4.8820 0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2840 3.4430 1.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7270 3.9140 1.1940 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.7370 4.9950 0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4050 3.2750 0.0660 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6350 3.2270 -1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3260 3.4920 -1.1090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9550 3.5290 -2.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7640 3.8690 -3.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7610 3.7550 -4.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8970 3.3250 -5.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0940 2.9950 -4.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0810 3.1160 -3.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5450 3.6430 2.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8020 2.3320 2.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5520 2.0970 4.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0530 3.1720 4.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8110 4.4790 4.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0600 4.7130 3.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9760 2.8830 6.1880 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 5.0210 0.7810 F 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 -0.0100 -0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 1.2290 0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0970 3.6360 0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9800 1.1240 -0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2670 2.3580 1.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8070 3.9030 2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3960 3.0570 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 4.2020 -2.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 4.0060 -5.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8420 3.2540 -6.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9760 2.6730 -5.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4190 1.4770 2.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7370 1.0760 4.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2010 5.3190 4.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8810 5.7430 2.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0740 2.9120 -2.2500 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.0220 2.6280 -2.4700 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 14 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 21 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 44 2 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 44 1 M END