MDPI-ZINC01728839 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 23 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -0.6140 1.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.6690 -1.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.1190 -1.0960 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3140 -2.5020 -0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 -2.8000 -2.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 -3.3470 -2.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3240 -2.7300 -1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6830 -2.8860 -1.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4360 -3.6490 -2.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 -4.2620 -3.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 -4.1110 -3.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -3.5700 -2.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0530 -2.0980 -3.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1580 -2.4070 -0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4970 -3.7660 -2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4180 -4.8580 -4.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 -4.5910 -4.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 11 12 2 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 13 22 1 0 0 0 0 M END