IBS-ZINC05453753 MOE2007 3D Structure written by MMmdl. 48 52 0 0 0 0 0 0 0 0999 V2000 1.4050 3.6810 -0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5800 2.2570 -0.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 1.6770 -1.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 0.2810 -2.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -0.4780 -1.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6460 0.1200 -0.4500 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5010 1.4220 -0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0400 0.6680 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5660 -0.4310 0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9150 -1.7790 0.4870 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1100 -2.9380 0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7450 -2.8990 0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 -4.0230 0.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4740 -5.2120 0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8240 -5.2740 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6550 -4.1370 -0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1060 -4.2140 -0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4190 -6.8060 -0.8250 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.0410 0.6590 2.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1930 -0.3140 3.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2430 0.0660 3.9630 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5870 -0.4510 4.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7690 1.2610 3.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0300 1.6600 2.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3930 2.8590 1.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4620 3.6160 2.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1710 3.1950 3.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8400 2.0080 4.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 3.7440 0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3530 4.2220 -0.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 4.1970 -1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 2.2220 -2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6590 -0.1350 -3.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 -1.5110 -1.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8760 -2.0320 0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3040 -1.9900 1.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -3.9760 0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 -6.0930 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7160 -4.5370 0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2600 -4.9040 -1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4770 -3.2490 -0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6490 -1.2260 3.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8680 3.1990 0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7460 4.5390 1.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 3.7960 3.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4000 1.6830 4.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3300 1.7810 0.8000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.4230 2.7080 1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 47 2 0 0 0 0 8 9 2 0 0 0 0 8 19 1 0 0 0 0 8 47 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 27 2 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 28 46 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 47 1 M END