IBS-ZINC05460418 MOE2007 3D Structure written by MMmdl. 39 42 0 0 0 0 0 0 0 0999 V2000 -7.1760 5.6590 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7550 6.7600 0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3950 7.0580 0.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4420 6.2390 0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8720 5.1420 -0.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2360 4.8540 -0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0560 6.5610 0.2360 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5630 7.8490 0.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1930 7.8210 0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8170 6.4690 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9650 5.6890 0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0080 4.2520 0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 3.5410 0.1600 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 2.2020 0.3400 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 1.4140 0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 0.0920 0.2910 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7320 -0.5010 0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 -0.3570 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8690 -1.6350 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2290 -1.7150 -0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9850 -0.5680 -0.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4180 0.7170 -0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0720 0.7790 -0.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2370 5.4380 -0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4890 7.3910 1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1060 7.9140 1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1810 4.5310 -1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5710 4.0120 -1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2250 8.7020 0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 8.6850 0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 6.0950 0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9540 3.7730 0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9750 1.7660 0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 -2.5080 0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7180 -2.6900 -0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0380 -0.6850 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9880 1.6030 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 1.8370 -0.2060 N 0 3 0 0 0 0 0 0 0 0 0 0 1.4010 2.8170 -0.3720 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 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 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 38 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 38 39 1 0 0 0 0 M CHG 1 38 1 M END