MDPI-ZINC03845702 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.7430 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.6960 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 0.0040 -2.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -0.6840 -3.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -2.0660 -3.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.7660 -2.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -2.0850 -1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -2.8130 -4.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 -3.0450 -5.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4340 -3.8030 -6.7100 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8310 -3.2640 -7.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8710 -3.9480 -7.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8380 -4.6460 -8.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0290 -5.9140 -8.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2220 -6.8920 -9.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 -8.0650 -9.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 -8.2700 -8.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 -7.3000 -7.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 -6.1190 -7.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 -5.1530 -6.5130 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -0.0400 2.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8570 -1.3820 1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 -1.3580 1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 1.0830 -2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -0.1400 -4.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -3.8460 -2.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -2.6310 -0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5050 -3.7730 -4.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 -2.2270 -5.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9350 -2.0850 -5.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9660 -3.6310 -4.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3220 -2.9620 -7.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4540 -4.5450 -6.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 -3.9780 -9.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8560 -4.8860 -8.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9460 -6.7380 -10.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -8.8240 -10.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -9.1860 -8.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 -7.4590 -6.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 -5.3700 -5.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 22 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 22 45 1 0 0 0 0 M END