IBS-ZINC05460131 MOE2007 3D Structure written by MMmdl. 45 49 0 0 1 0 0 0 0 0999 V2000 0.7240 4.4190 -3.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 5.6710 -2.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 5.8040 -1.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4240 4.6830 -0.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 3.4170 -0.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7230 3.2960 -2.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 2.2290 -0.0360 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1010 2.5700 1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3640 1.4070 -0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 0.0610 0.3990 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1270 -0.5490 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 -0.7110 0.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.0400 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 1.3740 -0.1810 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4270 1.7410 -0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0730 2.9710 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4720 2.9450 -0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1820 1.7430 -0.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5280 0.5080 -0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1440 0.5510 -0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4820 0.1650 1.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 -0.0150 2.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 0.1140 4.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9420 0.4230 4.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9920 0.6040 3.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7620 0.4750 2.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2170 0.5820 6.3580 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.7760 4.8260 0.7900 F 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 4.3160 -4.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0790 6.5410 -3.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 6.7730 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 2.3310 -2.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2620 1.9720 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4450 1.2040 -1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 -1.7240 0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 3.8970 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0270 3.8800 -0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2690 1.7770 -0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0630 -0.4230 -0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4300 -0.2600 2.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -0.0290 4.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9890 0.8440 4.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6000 0.6190 1.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2100 -0.4590 -0.3860 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4300 -1.4440 -0.4680 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