MDPI-ZINC04268231 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 72 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5150 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0400 -0.3690 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -0.6140 1.2140 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0150 -0.8040 2.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9610 0.1630 1.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1520 -0.5130 1.0600 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1920 -1.5380 1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9820 -0.5330 -0.4880 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7600 0.4720 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3850 -0.9200 -0.9490 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0370 0.2510 -1.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4860 -0.1360 -2.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5790 -1.3980 -2.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7930 -2.5780 -2.2690 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4160 -2.1200 -1.8540 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9430 -1.7650 -2.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4620 -3.2020 -1.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0620 -2.6170 -1.6710 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0970 -2.2190 -2.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8060 -1.4570 -0.7470 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2320 -1.9500 0.6020 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9440 -2.4490 1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 -2.8080 0.3580 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 -3.9670 -0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 -3.6270 -1.6260 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 -4.9540 0.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 -4.6590 -0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 -0.5410 -1.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 -0.2980 -2.3930 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6530 -3.6340 -3.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5690 -3.2220 -1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8470 -3.7050 -1.6100 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6550 -4.3010 -0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3060 -4.4160 0.4310 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9980 -4.8280 -1.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1620 -1.0570 0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4860 -0.0650 1.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8930 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8760 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8670 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9520 1.2200 1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0460 0.1040 2.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4960 0.4280 -2.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0100 1.1530 -1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9500 0.6880 -2.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0480 -0.2570 -1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2040 -1.1870 -3.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6320 -1.6880 -2.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6020 -4.1400 -1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5790 -3.3340 -0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 -5.2530 1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 -5.8340 -0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1970 -4.4760 0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5420 -3.9730 -1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 -5.5490 -1.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 -4.9440 0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6440 -3.9540 -3.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0980 -4.4930 -3.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1190 -3.1970 -4.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7360 -2.4840 -0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9950 -4.0570 -0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6000 -4.0080 -1.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5080 -5.2750 -0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8590 -5.5820 -1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0360 -2.0500 0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2100 -0.8000 0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 29 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 22 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 38 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 21 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 48 1 0 0 0 0 14 49 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 26 1 0 0 0 0 21 22 1 0 0 0 0 21 29 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 29 30 2 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 32 33 1 0 0 0 0 32 61 1 0 0 0 0 32 62 1 0 0 0 0 33 34 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 36 63 1 0 0 0 0 36 64 1 0 0 0 0 36 65 1 0 0 0 0 37 38 1 0 0 0 0 37 66 1 0 0 0 0 37 67 1 0 0 0 0 M END