TUE CCTOOLS-0919241036 38 40 0 0 0 0 0 0 0 0999 V2000 -4.1020 -1.2360 -0.7200 N 0 0 0 0 0 -5.3440 -1.4110 -0.3190 C 0 0 0 0 0 -6.0690 -2.4870 -0.8110 N 0 0 0 0 0 -5.9510 -0.5360 0.5930 C 0 0 0 0 0 -5.2520 0.5240 1.0850 C 0 0 0 0 0 -3.9220 0.7070 0.6510 C 0 0 0 0 0 -3.1450 1.7770 1.1170 C 0 0 0 0 0 -1.8640 1.9220 0.6770 C 0 0 0 0 0 -1.3150 1.0200 -0.2310 C 0 0 0 0 0 -2.0420 -0.0300 -0.7040 C 0 0 0 0 0 -3.3660 -0.2120 -0.2720 C 0 0 0 0 0 0.1050 1.2100 -0.6980 C 0 0 0 0 0 0.9920 0.5070 0.1760 O 0 0 0 0 0 4.0560 1.3720 -1.4780 N 0 0 0 0 0 2.7700 1.3020 -1.2000 C 0 0 0 0 0 2.3190 0.5760 -0.1070 C 0 0 0 0 0 3.2460 -0.0800 0.6960 C 0 0 0 0 0 4.5890 0.0190 0.3680 C 0 0 0 0 0 4.9610 0.7610 -0.7370 C 0 0 0 0 0 5.6320 -0.6730 1.2070 C 0 0 0 0 0 5.8600 -2.0230 0.6870 N 0 0 0 0 0 6.9980 -2.3340 0.1920 C 0 0 0 0 0 -5.6600 -3.0990 -1.4430 H 0 0 0 0 0 -6.9850 -2.6260 -0.5240 H 0 0 0 0 0 -6.9710 -0.7030 0.9060 H 0 0 0 0 0 -5.7040 1.2080 1.7880 H 0 0 0 0 0 -3.5600 2.4840 1.8210 H 0 0 0 0 0 -1.2660 2.7470 1.0370 H 0 0 0 0 0 -1.6010 -0.7200 -1.4080 H 0 0 0 0 0 0.2100 0.8210 -1.7110 H 0 0 0 0 0 0.3520 2.2710 -0.6890 H 0 0 0 0 0 2.0580 1.8160 -1.8300 H 0 0 0 0 0 2.9280 -0.6530 1.5540 H 0 0 0 0 0 6.0050 0.8420 -0.9980 H 0 0 0 0 0 6.5630 -0.1070 1.1700 H 0 0 0 0 0 5.2860 -0.7350 2.2390 H 0 0 0 0 0 7.7910 -1.6010 0.1570 H 0 0 0 0 0 7.1660 -3.3300 -0.1920 H 0 0 0 0 0 1 2 2 0 0 0 1 11 1 0 0 0 2 3 1 0 0 0 2 4 1 0 0 0 3 23 1 0 0 0 3 24 1 0 0 0 4 5 2 0 0 0 4 25 1 0 0 0 5 6 1 0 0 0 5 26 1 0 0 0 6 7 2 0 0 0 6 11 1 0 0 0 7 8 1 0 0 0 7 27 1 0 0 0 8 9 2 0 0 0 8 28 1 0 0 0 9 10 1 0 0 0 9 12 1 0 0 0 10 11 2 0 0 0 10 29 1 0 0 0 12 13 1 0 0 0 12 30 1 0 0 0 12 31 1 0 0 0 13 16 1 0 0 0 14 15 2 0 0 0 14 19 1 0 0 0 15 16 1 0 0 0 15 32 1 0 0 0 16 17 2 0 0 0 17 18 1 0 0 0 17 33 1 0 0 0 18 19 2 0 0 0 18 20 1 0 0 0 19 34 1 0 0 0 20 21 1 0 0 0 20 35 1 0 0 0 20 36 1 0 0 0 21 22 2 0 0 0 22 37 1 0 0 0 22 38 1 0 0 0 M END $$$$