MDPI-ZINC03844200 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 1 0 0 0 0 0999 V2000 -0.4940 1.4550 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 -0.0260 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 -0.6730 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 -2.1620 1.0780 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4060 -2.3440 1.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 -2.7860 -0.2480 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -2.0060 -1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 -2.5120 -2.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3310 -0.6940 -1.1520 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5550 -2.8600 2.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8660 -3.0860 1.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7360 -3.7260 2.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2960 -4.1430 3.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 -3.9160 4.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -3.2790 3.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 -4.3230 5.3550 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1510 -4.7720 4.6030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 0.0160 2.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 1.2280 2.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 -0.6700 3.5390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 0.0900 4.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 -0.8390 5.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 -1.1580 6.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3280 -2.0100 7.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 -2.5430 8.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 -2.2230 7.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 -1.3670 6.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 2.0000 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1440 1.7300 -0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9810 1.7060 1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4050 -3.7360 -0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5860 -0.1880 -1.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2100 -2.7610 0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7600 -3.9010 2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 -3.1060 3.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 -5.2210 5.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1650 -5.7340 4.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 0.7960 4.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3700 0.6370 4.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9340 -0.7420 5.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3390 -2.2600 7.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 -3.2090 8.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8680 -2.6400 8.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2720 -1.1150 6.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 M END