MDPI-ZINC03844361 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 39 0 0 1 0 0 0 0 0999 V2000 0.4330 1.3720 0.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3430 -0.1490 0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 -0.5570 -0.7770 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 -1.8700 -1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4900 -2.6520 -0.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 -2.3690 -2.3100 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2110 -1.9180 -3.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1690 -1.9840 -2.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8120 -2.3740 -3.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1540 -2.9040 -4.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5600 -3.8680 -2.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 -4.4440 -3.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 -5.8070 -3.4280 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 -6.5790 -2.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2330 -7.7880 -2.5730 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0620 -6.0310 -1.5110 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1950 -4.6920 -1.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8520 -4.1960 -0.5280 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7100 -6.8940 -0.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -6.4320 -4.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 -3.5900 -4.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 1.6720 0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 1.8480 -0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 1.6780 1.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8270 -0.6250 1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7040 -0.4490 0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2620 -0.9080 -2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6650 -2.5050 -1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4960 -7.9370 -0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7870 -6.7290 -0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3280 -6.6560 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 -6.7020 -5.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 -7.3290 -4.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7960 -5.7310 -4.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7790 -2.7180 -4.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -4.1700 -5.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 -3.2630 -4.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1170 -2.1310 -3.7940 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4840 -2.3990 -4.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 10 2 0 0 0 0 9 38 1 0 0 0 0 11 12 2 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 20 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 19 29 1 0 0 0 0 19 30 1 0 0 0 0 19 31 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 38 39 1 0 0 0 0 M END