MDPI-ZINC03844572 MOE2007 3D Structure written by MMmdl. 27 29 0 0 0 0 0 0 0 0999 V2000 2.4760 8.6080 4.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6810 7.9190 4.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9630 6.8520 3.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0360 6.4680 2.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 7.1560 2.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5530 8.2290 3.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 6.7600 1.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 7.4010 1.4980 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 5.5840 0.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 5.2010 -0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 4.0840 -0.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5300 3.3260 -0.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5170 3.6850 0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3250 4.8500 0.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3510 5.3460 1.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4810 4.8770 1.9220 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6240 2.8730 0.3030 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4380 2.0290 1.1890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6870 2.1400 -1.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7090 2.1180 -2.4610 O 0 5 0 0 0 0 0 0 0 0 0 0 2.2550 9.4400 5.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4020 8.2140 5.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9080 6.3210 3.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 8.7710 3.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 5.7650 -0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 3.7860 -1.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 1.2880 -1.6830 O 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 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 15 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 12 13 2 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 19 27 2 0 0 0 0 M CHG 1 20 -1 M END