IFLAB-ZINC04315386 MOE2007 3D Structure written by MMmdl. 48 51 0 0 1 0 0 0 0 0999 V2000 -1.2430 2.3900 -0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0750 3.7570 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 4.3180 0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 3.4400 0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 2.0900 -0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 1.5170 -0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3640 1.5490 -0.2560 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5540 0.5660 -0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2850 2.4890 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7760 2.3020 0.0080 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1550 3.2610 0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2380 1.1960 0.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7540 1.0390 0.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2790 0.7970 -0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3300 2.0840 -1.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3880 1.7870 -2.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8700 2.0280 -2.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3860 3.3260 -2.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7630 3.5490 -2.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6510 2.4790 -2.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1350 1.1830 -3.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7570 0.9590 -3.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1350 2.7210 -3.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5580 2.9350 -4.3200 F 0 0 0 0 0 0 0 0 0 0 0 0 13.5330 3.8080 -2.3280 F 0 0 0 0 0 0 0 0 0 0 0 0 13.8680 1.6760 -2.5730 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.2500 2.0040 -0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9560 4.3920 0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 5.3650 0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2690 0.4670 -0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9030 1.4190 1.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7680 0.2440 0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0450 0.2040 1.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2200 1.9410 1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8960 -0.1390 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3730 0.7800 -0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9100 1.1840 -1.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1010 2.9470 -2.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1090 0.7910 -3.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8730 2.5270 -3.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7250 4.1820 -2.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1430 4.5660 -2.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8080 0.3400 -3.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3920 -0.0600 -3.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6230 3.6330 0.2140 N 0 3 0 0 0 0 0 0 0 0 0 0 3.0510 4.5240 0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8310 1.9260 -1.3760 N 0 3 0 0 0 0 0 0 0 0 0 0 7.2440 2.7910 -1.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 45 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 45 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 14 47 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 47 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 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 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