IBS-ZINC04026702 MOE2007 3D Structure written by MMmdl. 44 48 0 0 1 0 0 0 0 0999 V2000 0.6730 2.1890 -3.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 1.3810 -2.4980 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2850 0.3140 -2.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 1.6880 -3.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6630 2.7860 -2.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8610 3.3920 -3.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6720 3.2140 -4.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8130 4.0080 -4.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1510 4.9690 -3.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3620 5.1660 -2.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2240 4.3630 -2.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2770 4.3500 -1.1830 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2890 4.9830 -0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3530 3.3750 -1.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1380 3.0580 -0.6590 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3190 3.6870 -1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 1.1340 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 1.6150 1.2520 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5490 0.9900 1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0510 3.0520 0.8660 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2030 3.7160 1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2050 3.4920 1.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8800 3.1850 3.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 2.3710 3.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 1.6080 2.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 2.0250 -2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9210 1.8820 -4.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 3.2630 -3.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4530 0.7780 -3.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6180 1.9270 -4.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4180 2.4700 -5.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4420 3.8740 -5.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0410 5.5770 -3.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6290 5.9180 -1.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2450 0.0460 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 1.6300 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3650 4.5710 1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1380 2.9840 1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4900 3.6740 3.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 2.2280 4.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 2.0660 2.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 0.5760 2.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7680 1.6160 -1.0260 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6380 1.0880 -0.8630 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 3 1 0 0 0 0 2 4 1 0 0 0 0 2 43 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 14 2 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 15 43 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 25 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 43 44 1 0 0 0 0 M CHG 1 43 1 M END