MDPI-ZINC03844478 MOE2007 3D Structure written by MMmdl. 46 49 0 0 0 0 0 0 0 0999 V2000 1.4290 4.5120 -0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 3.2390 -0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1150 1.9510 -0.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 1.1420 -0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 1.9390 -0.2480 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5390 1.4700 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6270 -0.0960 -0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4680 -0.7720 -1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5540 -2.1690 -1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8240 -2.9270 -0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0160 -2.2900 0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 -0.8950 0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2700 2.1900 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3340 3.0970 -1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9280 3.7310 -2.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 3.4870 -3.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4060 2.6140 -3.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8120 1.9800 -2.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0360 1.8420 1.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1710 2.2890 2.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6450 2.5650 3.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9860 2.3670 3.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8530 1.8710 3.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3810 1.5970 1.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7440 4.8110 -1.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 5.2520 0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 4.3700 0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1580 1.7980 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 0.0860 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0950 -0.2370 -1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2070 -2.6660 -1.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8990 -4.0120 -0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 -2.8770 1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3030 -0.4340 1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7200 3.3620 -0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7510 4.4260 -2.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9340 3.9820 -4.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0390 2.4240 -4.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9810 1.3040 -2.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 2.4110 2.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9600 2.9200 4.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 2.5770 4.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8950 1.6850 3.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0830 1.1760 1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6650 3.2170 -0.4390 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.2440 4.0540 -0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 5 1 0 0 0 0 2 45 2 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 3 45 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 13 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 45 1 M END