MDPI-ZINC01576954 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 23 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4070 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 -0.9860 -1.0080 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 -2.2780 -0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 -2.6000 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6440 -1.6990 -0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3540 -0.3980 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0930 0.7470 -0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 1.8370 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5560 0.8260 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0520 0.8600 -1.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4780 0.9370 -1.4870 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3270 -0.6810 0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 2.0270 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 -3.6450 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8760 1.7310 0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9710 -0.0460 0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7310 -0.0450 -1.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6360 1.7320 -1.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8630 0.9620 -2.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5990 0.2500 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9980 -1.3820 0.0240 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 14 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 10 17 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 11 19 1 0 0 0 0 12 20 1 0 0 0 0 13 21 1 0 0 0 0 13 22 1 0 0 0 0 M END