MDPI-ZINC03846204 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 1 0 0 0 0 0999 V2000 -1.0000 1.8790 0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6780 0.4100 -0.0830 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3830 0.2790 -1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 -0.0900 0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -1.6220 0.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 -1.7750 0.8700 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8900 -0.4820 0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6710 -0.8060 -1.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7990 0.2250 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8460 -1.9480 2.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7170 -2.9620 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9210 -3.4480 -0.7390 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1030 -3.5420 0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2400 -4.7290 -0.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5760 -5.2880 -0.6990 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8630 -6.3480 -1.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0200 -6.7940 -2.2320 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2020 -6.9690 -1.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5020 -8.0680 -2.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7540 -8.6430 -2.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7120 -8.1330 -1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4210 -7.0440 -0.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1710 -6.4630 -0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 2.4910 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8260 2.1980 -0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2800 1.9950 1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 0.1480 0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 0.3310 1.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 -2.0850 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -2.0590 1.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 -1.4520 -1.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5990 -1.3150 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9010 0.1190 -1.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1730 1.1510 0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6390 -0.4240 1.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2340 0.4510 2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5560 -1.0860 2.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9330 -2.0300 2.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4210 -2.8530 2.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2720 -3.8770 1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8380 -2.7800 -0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0710 -4.3940 -1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5050 -5.4910 -0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7560 -8.4660 -2.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9880 -9.4930 -2.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6910 -8.5870 -1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1730 -6.6510 0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9440 -5.6160 0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 M END