MDPI-ZINC03845401 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 1 0 0 0 0 0999 V2000 -0.1070 1.8340 -0.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 0.4590 -0.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 -0.2590 -0.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2480 0.3990 -0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2620 1.7730 -0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 2.4910 -0.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5310 -0.3840 -0.4390 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3230 -1.4440 -0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1460 -0.1630 0.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3440 -1.0610 1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6520 -1.8320 0.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1410 -1.0030 2.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2540 -1.8350 2.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9960 -1.7750 3.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6410 -0.8950 4.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5410 -0.0680 4.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7930 -0.1120 3.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5120 0.0900 -1.5140 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4100 -0.5260 -1.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8560 -0.0310 -2.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8800 1.5290 -1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3670 2.4090 -1.9090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0260 2.3940 -0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0510 -0.0550 -1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 -1.3330 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1920 2.2870 -0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 3.5650 -0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4550 0.8780 1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4070 -0.3970 1.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5320 -2.5230 1.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8550 -2.4170 3.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2250 -0.8530 5.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2700 0.6160 5.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9370 0.5370 3.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9070 0.5040 -2.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5150 0.3980 -3.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9800 -1.8590 -2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -1.4480 -3.1970 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2850 -1.5630 -4.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7770 1.8340 -0.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9810 2.7700 -0.1800 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 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 26 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 18 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 40 41 1 0 0 0 0 M END