MDPI-ZINC03845549 MOE2007 3D Structure written by MMmdl. 47 51 0 0 0 0 0 0 0 0999 V2000 -8.5940 -2.0930 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1000 -1.5370 1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8850 -0.8500 1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1480 -0.7100 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6570 -1.2790 -1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8740 -1.9650 -1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8720 0.0190 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6680 -0.7010 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4360 -0.0360 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2070 -0.7120 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 0.0050 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 -0.6380 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 0.1020 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3250 1.4990 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 2.1330 0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 1.4110 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 2.0710 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4350 1.3690 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8130 1.4260 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9290 2.2330 0.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4310 2.3230 0.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7300 -0.5970 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2090 -1.2580 1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4360 -1.9240 1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2000 -1.9400 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7380 -1.2910 -1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5110 -0.6250 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5400 -2.6290 0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6620 -1.6420 2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5150 -0.4290 2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1120 -1.1900 -2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2590 -2.4020 -2.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6970 -1.7910 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 -1.8010 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 -1.7260 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2130 3.1590 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9110 3.2430 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8490 1.8020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3730 1.9610 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2560 3.3170 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6310 -1.2540 2.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7970 -2.4300 1.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1540 -2.4590 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3330 -1.3050 -2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1670 -0.1260 -2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6100 2.0220 0.0190 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.6080 3.0370 0.0210 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 14 15 2 0 0 0 0 14 21 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 46 2 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 45 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END