MDPI-ZINC03844246 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 1 0 0 0 0 0999 V2000 0.2690 0.7340 0.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 -0.5980 0.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8230 -1.0040 0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8840 -0.0850 0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6070 1.2560 0.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 1.6600 0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2920 -0.5480 -0.0440 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2900 -1.6420 -0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7270 -0.0120 -1.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0030 -0.6940 -1.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4520 -0.3060 -3.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7490 0.5500 -3.9340 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2970 -0.1450 1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7670 0.9890 1.1240 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7380 -1.1610 2.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0120 -1.0170 2.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4770 -1.9510 3.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6720 -3.0260 3.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3990 -3.1650 3.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9280 -2.2320 2.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 1.0500 1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 -1.3210 0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9980 -2.0470 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.9980 0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 2.7020 1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9230 -0.1870 -2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8820 1.0740 -1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8350 -0.4700 -1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8610 -1.7820 -1.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6510 -0.1840 2.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4700 -1.8390 3.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0350 -3.7550 4.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7690 -4.0010 3.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9240 -2.3590 2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4910 -0.9130 -3.7240 O 0 5 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 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 23 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 24 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 19 2 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 M CHG 1 35 -1 M END