IBS-ZINC05459130 MOE2007 3D Structure written by MMmdl. 45 49 0 0 1 0 0 0 0 0999 V2000 -7.0670 3.1680 4.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8880 4.4640 4.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1310 4.6870 3.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5420 3.6150 2.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7330 2.3130 2.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4900 2.0930 4.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7290 3.8710 1.1920 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.7820 4.9420 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2680 3.4670 1.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5090 3.8050 0.0800 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4020 4.8920 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3100 3.4250 -1.0930 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9410 3.4410 -2.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7670 3.8170 -3.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7600 3.6640 -4.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8750 3.1640 -5.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0560 2.7980 -4.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0490 2.9580 -3.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6060 3.1080 -1.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3780 3.1600 0.0900 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 3.1110 0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 1.7430 -0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 1.0820 -0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 1.7660 0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 3.1130 0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 3.7800 0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 5.4420 0.9530 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -7.6550 2.9950 5.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3380 5.3020 4.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0060 5.7100 2.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2940 1.4560 2.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6270 1.0820 4.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2050 2.3900 1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8140 3.9780 2.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 4.2030 -2.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8650 3.9390 -5.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8180 3.0650 -6.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9230 2.4210 -5.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3580 2.8980 0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9400 1.1740 -0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 0.0270 -0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2840 1.2500 0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1580 3.6350 0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0310 2.7360 -2.2130 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.9650 2.4040 -2.4240 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 31 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 20 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 19 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 44 2 0 0 0 0 20 39 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 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 44 1 M END