LJW5R2 -OEChem-05032301373D 36 37 0 1 0 0 0 0 0999 V2000 2.4912 0.0077 1.5999 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0292 -0.5599 1.9068 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6027 -2.5944 -1.7388 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9171 -2.7826 -0.1187 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6649 3.2649 -2.1203 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2116 2.4019 -1.1095 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4913 -1.9262 0.1982 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2748 0.6066 -0.9006 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2268 -0.2514 -0.1859 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7776 -1.6968 -0.3932 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6402 1.8060 1.5163 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4261 2.3850 0.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9529 1.7490 -0.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6115 -2.3629 -0.5325 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7443 -2.6718 0.2296 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8391 -2.5281 0.3425 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7041 -1.2966 0.3956 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0154 2.5078 -1.2547 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7582 3.4176 1.3927 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3120 -0.6304 -0.6457 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0543 0.5000 -0.1968 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9855 0.6545 1.1702 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2074 -0.1231 -0.6606 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7310 -1.9288 -1.4638 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3944 -1.7778 1.1989 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5405 2.0686 0.9504 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7708 2.1842 2.5355 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3533 -3.3101 1.0419 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5330 -2.8509 1.3452 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4281 -3.3560 -0.0726 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0949 3.8724 2.3196 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1336 3.8447 0.9496 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2318 -0.9351 -1.6814 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6098 1.1662 -0.8439 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4507 1.4228 1.7715 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0739 3.7908 -2.7002 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 11 1 0 0 0 0 2 17 1 0 0 0 0 2 22 1 0 0 0 0 3 14 2 0 0 0 0 4 15 2 0 0 0 0 5 18 1 0 0 0 0 5 36 1 0 0 0 0 6 18 2 0 0 0 0 7 10 1 0 0 0 0 7 14 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 10 15 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 19 2 0 0 0 0 13 18 1 0 0 0 0 14 16 1 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 17 20 2 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 21 22 2 0 0 0 0 21 34 1 0 0 0 0 22 35 1 0 0 0 0 M END $$$$