IFLAB-ZINC04315334 MOE2007 3D Structure written by MMmdl. 48 51 0 0 1 0 0 0 0 0999 V2000 -5.5920 14.4080 -2.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1710 12.9690 -2.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8320 12.6290 -2.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4320 11.2910 -2.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3650 10.2680 -2.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7020 10.6120 -2.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0990 11.9520 -2.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9380 8.8260 -2.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8790 8.2020 -0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4930 7.7560 1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7200 6.4420 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4880 6.5270 0.1390 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7880 7.2500 0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8640 7.0060 -1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6970 5.2490 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1590 4.0350 -0.2320 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1230 3.8090 -0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 3.1040 -0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 1.7430 -0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 1.1080 -0.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 1.8120 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 3.1870 0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 3.8010 0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5010 14.7940 -3.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6300 14.5220 -2.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9720 15.0180 -2.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0910 13.4090 -2.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3810 11.0640 -2.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4530 9.8470 -3.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1410 12.1990 -3.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0210 8.7160 -3.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6960 8.1630 -3.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3480 9.1890 -0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5550 7.4880 -0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8830 8.5330 1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3970 7.6430 1.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3790 5.6340 0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4160 6.1800 2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9620 7.1850 -1.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4920 6.2750 -1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0300 1.2130 -0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 0.0400 -0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 1.2710 0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1290 3.7340 0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 5.1110 0.3570 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2330 5.8580 0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6330 8.3050 -1.2030 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.0320 9.0210 -0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 30 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 8 47 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 9 47 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 45 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 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 45 46 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 45 1 M CHG 1 47 1 M END