IBS-ZINC05041012 MOE2007 3D Structure written by MMmdl. 37 39 0 0 0 0 0 0 0 0999 V2000 8.5250 2.1150 -0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6730 0.3870 1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0850 2.0540 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8280 1.1730 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6230 1.9810 0.0750 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 1.3410 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 2.0300 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 1.3430 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 2.2970 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4830 2.2050 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2370 3.3830 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6210 4.6340 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2270 4.7460 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 3.5600 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 3.3690 0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5560 4.1190 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9570 3.2850 -0.1140 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 -0.0070 -0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 -0.5980 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 -0.0120 0.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6980 2.8180 0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3970 1.4740 -0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2820 2.6410 -1.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8730 -0.3450 1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6130 -0.1370 0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7600 1.0380 1.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0390 2.7290 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1820 2.6570 0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8330 0.5590 1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8450 0.5010 -0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6580 2.9900 0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9650 1.2320 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2240 5.5390 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 5.7190 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 -1.6830 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3560 1.2360 -0.0840 N 0 3 0 0 0 0 0 0 0 0 0 0 7.2240 0.5960 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 36 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 20 2 0 0 0 0 7 8 2 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 36 37 1 0 0 0 0 M CHG 1 36 1 M END