B1AUH6 -OEChem-04012112063D 38 40 0 0 0 0 0 0 0999 V2000 1.9719 -3.5929 0.0964 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4321 -2.5384 -1.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1786 0.0353 -0.3043 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6097 2.2948 0.3533 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8002 1.3369 -0.4791 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4342 1.2272 -0.2275 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6039 0.1266 -0.8389 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2926 2.3747 0.1064 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4957 -0.0446 -0.0575 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2224 1.1028 0.2764 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4541 2.5653 -0.4044 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3669 3.5999 0.1795 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1830 -0.5686 0.3665 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1553 -1.2698 -0.1307 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7335 3.7030 -0.0732 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5885 0.9931 0.5281 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4275 -1.8830 0.5285 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5219 -1.3729 0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2424 -0.2353 0.4532 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0092 -2.5118 1.7628 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1266 -2.8560 -0.5806 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4278 -2.4861 -0.4759 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4363 0.4297 -1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9911 -0.5427 -1.4511 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5198 2.6468 -0.5992 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1879 4.4995 0.4385 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4516 0.0828 1.1984 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2289 4.6669 -0.0104 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1646 1.8789 0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0521 -2.3188 0.0546 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3083 -0.2987 0.6496 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1960 -1.7677 2.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9610 -3.0006 1.5319 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3204 -3.2588 2.1704 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9545 -2.3925 -1.5541 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2474 -3.4558 -0.3237 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9735 -3.5383 -0.7167 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 -4.4068 -0.1403 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 1 38 1 0 0 0 0 2 22 2 0 0 0 0 3 6 1 0 0 0 0 3 9 2 0 0 0 0 4 8 1 0 0 0 0 4 10 2 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 5 11 1 0 0 0 0 6 8 1 0 0 0 0 7 13 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 8 12 2 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 16 1 0 0 0 0 11 15 2 0 0 0 0 11 25 1 0 0 0 0 12 15 1 0 0 0 0 12 26 1 0 0 0 0 13 17 2 0 0 0 0 13 27 1 0 0 0 0 14 18 2 0 0 0 0 14 22 1 0 0 0 0 15 28 1 0 0 0 0 16 19 2 0 0 0 0 16 29 1 0 0 0 0 17 20 1 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 19 31 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 M END $$$$