MDPI-ZINC03852652 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 34 0 0 1 0 0 0 0 0999 V2000 -0.0040 1.4210 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 0.0690 0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 -0.6910 0.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4810 -2.0340 0.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7810 -2.2300 0.3080 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2520 -0.9930 -0.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2610 -0.0430 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3930 1.2550 -0.4200 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 1.9420 -0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -0.7610 -0.2970 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7270 0.1610 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6610 -0.7130 0.8860 C 0 0 3 0 0 0 0 0 0 0 0 0 6.6010 -0.3150 0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9000 -2.2090 1.1000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0940 -2.6910 1.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9180 -2.7560 -0.3250 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4160 -3.7280 -0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1490 -1.8390 -1.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3060 -2.8730 -0.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1690 -3.2990 -2.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4110 -2.7840 -2.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1090 -2.4120 1.8180 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0550 -1.7200 2.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1930 -0.1620 1.9930 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6400 -3.0100 0.8950 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8840 2.0550 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0380 -0.3760 0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 2.9930 -0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8230 -1.9090 -0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9280 -3.6030 -0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 -2.8770 1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 -3.9460 1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 9 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 24 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 22 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 29 1 0 0 0 0 19 30 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 25 31 1 0 0 0 0 25 32 1 0 0 0 0 M CHG 1 24 -1 M END