L5KX1D -OEChem-05022322393D 38 39 0 1 0 0 0 0 0999 V2000 2.7569 1.7579 0.7015 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9679 0.1622 0.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6464 -3.3227 -1.7382 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8502 1.1009 -0.5418 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3864 0.0028 0.0502 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4503 -1.5558 -0.1333 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7947 0.2779 -0.0084 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0826 -1.2883 -0.1917 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9529 -2.9356 -0.3938 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5123 1.0265 0.3502 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3490 -0.5320 0.1669 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8799 0.7592 0.4085 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7373 -0.3207 0.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5432 1.1529 -0.8145 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3558 -3.9740 0.5608 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6895 -1.3312 1.8518 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0565 2.0642 -1.8642 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3914 3.0794 0.3064 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6482 3.8764 0.0286 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6159 -2.0837 -0.4426 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0448 -2.9652 -0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1214 2.0174 0.5677 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4170 -0.7298 0.2144 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2787 -4.1003 0.4064 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5297 -3.7020 1.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8076 -4.9556 0.3787 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6236 -2.3363 1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5858 -1.2886 2.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8231 -1.1762 2.5023 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3065 1.5727 -2.4926 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8681 2.3965 -2.5203 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5996 2.9529 -1.4171 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 3.5531 1.1151 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7921 3.0799 -0.6129 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0073 -4.2153 -1.8751 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4050 4.9007 -0.2675 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2339 3.4075 -0.7691 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2885 3.9083 0.9163 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 18 1 0 0 0 0 2 4 1 0 0 0 0 2 13 1 0 0 0 0 3 9 1 0 0 0 0 3 35 1 0 0 0 0 4 14 2 0 0 0 0 5 7 1 0 0 0 0 5 8 2 0 0 0 0 5 10 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 6 11 2 0 0 0 0 7 13 2 0 0 0 0 7 14 1 0 0 0 0 8 20 1 0 0 0 0 9 15 1 0 0 0 0 9 21 1 0 0 0 0 10 12 2 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 13 16 1 0 0 0 0 14 17 1 0 0 0 0 15 24 1 0 0 0 0 15 25 1 0 0 0 0 15 26 1 0 0 0 0 16 27 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 M END $$$$