B3U7BM -OEChem-04012113283D 27 26 0 0 0 0 0 0 0999 V2000 1.2292 -1.2052 -0.0012 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8072 0.1749 0.0001 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7649 0.8854 1.2638 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 0.8932 -1.2589 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7228 0.0361 -0.0006 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.5301 -0.9092 0.0052 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6284 0.9647 -1.2026 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0098 -0.7719 -0.0836 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7230 0.8607 1.2786 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2305 -0.1211 0.0051 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2832 -0.8076 -0.0059 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6192 -1.5458 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6112 -1.5404 -0.8885 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4433 0.3647 -2.0984 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5842 1.4902 -1.2983 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8404 1.7057 -1.0457 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0553 -1.4386 0.7827 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8582 -0.0810 -0.0774 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9963 -1.3496 -1.0125 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6434 0.1830 2.1336 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8994 1.5782 1.2644 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6683 1.4111 1.3253 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1303 0.5064 -0.8829 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1347 0.5118 0.8897 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2962 -1.4242 -0.9065 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1415 -0.1322 -0.0055 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2997 -1.4298 0.8908 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 11 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 6 10 1 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 7 14 1 0 0 0 0 7 15 1 0 0 0 0 7 16 1 0 0 0 0 8 17 1 0 0 0 0 8 18 1 0 0 0 0 8 19 1 0 0 0 0 9 20 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 M CHG 1 5 1 M END $$$$