IBS-ZINC05346415 MOE2007 3D Structure written by MMmdl. 55 57 0 0 0 0 0 0 0 0999 V2000 6.3020 7.0280 -2.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9840 6.6300 -1.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5150 8.7920 0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9750 9.2030 0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9110 6.8750 0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7760 5.3700 0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3640 5.0020 1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2720 3.5700 1.2830 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0910 2.9900 1.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 1.5910 1.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7690 0.4390 1.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0370 -0.6740 2.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -0.2560 2.4830 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 1.1330 2.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 1.9140 2.6300 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 3.2110 2.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 3.7800 1.9890 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 -1.1310 2.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4310 -0.6130 3.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4640 -1.4690 3.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 -2.8250 3.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 -3.2710 3.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2270 -2.4660 2.6610 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4890 -2.1000 2.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1610 0.4340 1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 6.7230 -2.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3560 8.1050 -2.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7990 6.5350 -3.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0430 6.9050 -1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9470 5.5470 -0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9810 9.2330 -0.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0310 9.1140 1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4700 9.0380 -0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0530 10.2730 0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5240 8.6590 1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2950 7.2310 -0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6130 7.4070 1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5100 5.0310 1.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9850 4.8260 -0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6330 5.3310 0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1490 5.5230 2.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0690 2.9810 1.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 3.8850 2.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 0.4320 3.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3320 -1.0680 4.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1620 -3.5100 3.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1070 -4.3230 2.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 -2.6870 1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5720 -2.1870 2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2630 -2.5480 3.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2110 0.9870 0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8450 0.8970 1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5280 -0.5740 0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3600 7.2770 0.1190 N 0 3 0 0 0 0 0 0 0 0 0 0 6.8950 6.9120 0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 2 54 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 54 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 5 54 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 17 2 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 11 12 2 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 43 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 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END