IBS-ZINC04674731 MOE2007 3D Structure written by MMmdl. 56 59 0 0 0 0 0 0 0 0999 V2000 5.0970 -4.2940 -2.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3960 -3.3910 -0.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6510 -2.0600 -1.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9440 -1.1610 0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2390 0.1910 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9170 1.2740 -0.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2460 2.4290 -0.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9740 2.5940 -0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 3.5110 0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 4.3900 1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 3.9820 2.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 2.7640 2.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 1.8840 2.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4280 2.2640 1.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4700 1.6510 0.5120 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0140 0.3780 0.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2990 -0.6270 1.2320 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 -1.0000 0.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 -2.2570 0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5730 -2.7110 -0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1770 -3.5920 0.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5010 -3.9930 0.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2340 -3.5160 -0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6440 -2.6360 -1.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 -2.2320 -1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7460 3.5220 -1.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0990 4.4480 -2.2910 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3130 1.0370 -1.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6400 -5.2400 -2.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0280 -4.5210 -2.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4020 -3.8220 -3.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4760 -3.2100 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1090 -3.9060 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5760 -2.2550 -1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9330 -1.5600 -2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0250 -1.0290 0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6510 -1.6930 1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 5.3390 0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 4.6310 2.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 2.5010 3.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8990 0.9660 2.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8170 -1.2210 1.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 -1.1890 1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -0.1930 0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 -2.0630 -0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4350 -3.0680 0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6210 -3.9750 1.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9620 -4.6800 1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2640 -3.8310 -0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2160 -2.2670 -2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 -1.5440 -1.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3400 0.1880 -1.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7150 1.8920 -1.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0090 0.8520 -0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1770 3.6540 -0.3390 N 0 3 0 0 0 0 0 0 0 0 0 0 2.3050 4.4810 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 16 2 0 0 0 0 6 7 2 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 15 1 0 0 0 0 8 55 2 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 9 55 1 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 3 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 55 1 M END