BT12UN -OEChem-04022113323D 39 39 0 1 0 0 0 0 0999 V2000 0.6580 1.8294 -0.4429 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9702 0.8922 -0.1841 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8634 2.7538 0.6569 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8114 2.2774 -1.8142 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8237 -0.3108 0.1921 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 -1.9134 0.8942 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3869 -4.2007 -0.4684 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6127 0.4141 -0.2001 N 0 0 2 0 0 0 0 0 0 0 0 0 0.7724 -3.0259 -1.1278 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7241 0.0180 0.6459 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9804 1.1926 -0.2531 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4046 -0.7239 -1.1263 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4285 0.7846 1.0034 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8238 1.0954 -1.3599 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2015 0.1631 0.3143 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4363 0.3401 2.1043 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7199 0.2794 1.1529 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1153 0.5900 -1.2102 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9793 -1.9283 -0.3276 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5634 0.1821 0.0462 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2167 -0.7093 1.5046 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4676 -1.0302 0.4559 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3272 -0.9542 -1.6706 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6357 -0.5043 -1.8727 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7805 0.8501 1.8733 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 1.4029 -2.3494 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5367 1.1948 0.4674 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8169 -0.5006 0.9293 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3798 -0.0720 -0.7406 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6528 1.3921 2.3209 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0370 -0.2841 2.7732 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3807 0.1805 2.3479 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0028 -0.0204 2.1562 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7677 0.5156 -2.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7543 -3.0373 -2.1412 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2463 -1.0756 1.4364 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2244 0.1391 2.1974 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6056 -1.5404 1.8727 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2517 -4.6341 -0.3698 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 8 1 0 0 0 0 1 11 1 0 0 0 0 2 8 1 0 0 0 0 2 10 1 0 0 0 0 5 20 1 0 0 0 0 5 21 1 0 0 0 0 6 19 2 0 0 0 0 7 9 1 0 0 0 0 7 39 1 0 0 0 0 8 12 1 0 0 0 0 9 19 1 0 0 0 0 9 35 1 0 0 0 0 10 15 1 0 0 0 0 10 16 1 0 0 0 0 10 22 1 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 12 19 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 13 17 1 0 0 0 0 13 25 1 0 0 0 0 14 18 2 0 0 0 0 14 26 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 15 29 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 20 2 0 0 0 0 17 33 1 0 0 0 0 18 20 1 0 0 0 0 18 34 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 M END $$$$