MDPI-ZINC03849368 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 37 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7120 1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -0.2970 2.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 0.9420 3.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 1.0040 4.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -0.1610 5.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -1.3930 4.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -1.4780 3.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -2.5540 2.5110 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -3.4840 2.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.1170 1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.8080 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.1080 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6930 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -0.2860 -2.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 0.8580 -3.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -1.3930 -3.3800 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -2.5050 -2.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -3.6460 -3.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 -1.3870 -4.7450 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.3150 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 1.8510 2.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 1.9640 5.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -0.1020 6.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -2.2940 5.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 -2.3280 -5.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 -0.8700 -5.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 -4.6920 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -4.6650 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5870 -4.6770 0.8620 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 2 0 0 0 0 2 15 1 0 0 0 0 3 4 1 0 0 0 0 3 12 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 26 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 14 15 2 0 0 0 0 14 19 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 21 1 0 0 0 0 19 20 2 0 0 0 0 21 30 1 0 0 0 0 21 31 1 0 0 0 0 22 32 1 0 0 0 0 22 33 1 0 0 0 0 22 34 1 0 0 0 0 M END