IBS-ZINC05459065 MOE2007 3D Structure written by MMmdl. 51 55 0 0 1 0 0 0 0 0999 V2000 8.5660 0.6170 6.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1050 1.0370 6.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4110 0.8570 5.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7820 -0.3530 4.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1510 -0.5260 3.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1450 0.5050 2.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7730 1.7190 3.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4050 1.8900 4.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4360 0.3020 1.4340 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2560 -0.7680 1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1010 1.0480 1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5700 1.1100 0.0120 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4680 0.0900 -0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4770 1.8180 -0.8910 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7660 1.4690 -0.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2590 0.7480 0.3040 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6000 0.4510 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5440 -0.3430 0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8220 -0.3770 0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1330 0.3480 -1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1760 1.1380 -1.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9150 1.1580 -1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 1.7940 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 1.0670 -0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 1.6840 -0.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 3.0290 -0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1810 3.7700 0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 3.1550 0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4890 3.6200 -0.2610 F 0 0 0 0 0 0 0 0 0 0 0 0 8.6640 -0.4380 6.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1170 1.2100 5.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0440 0.7580 7.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0350 2.0860 6.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5860 0.4550 7.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7760 -1.1680 5.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -1.4780 3.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7800 2.5460 2.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8920 2.8370 4.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2340 2.0660 1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 0.5480 2.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1770 2.3720 -1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3110 -0.9010 1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5990 -0.9800 0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1410 0.2880 -1.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4000 1.6930 -2.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1570 0.0120 -0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0490 1.1240 -0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 4.8190 0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 3.7490 0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7570 1.7910 -1.5280 N 0 3 0 0 0 0 0 0 0 0 0 0 5.6630 2.3680 -2.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 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 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 16 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 23 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 50 2 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 50 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 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 50 1 M END