B61GXD -OEChem-04012112333D 31 32 0 1 0 0 0 0 0999 V2000 1.0131 -1.1488 -0.5976 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8002 2.9710 0.5018 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9836 1.1366 -0.7576 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2811 0.7405 -0.1784 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0863 -0.7145 0.2328 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4107 -0.0020 -0.9868 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6301 1.6499 0.9878 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9033 -0.1813 -1.6529 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2840 -1.5701 0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0345 -0.1349 -0.6607 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4623 -1.3090 -0.0564 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6337 1.0814 -0.3634 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8566 -2.3276 0.9423 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5103 -1.2660 0.8631 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6816 1.1242 0.5562 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1198 -0.0495 1.1695 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0365 0.8518 -0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7421 -0.7955 1.2723 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5629 1.3316 1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8325 1.6609 1.7384 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9101 -1.1315 -2.2008 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0275 0.6018 -2.4108 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7046 -1.5896 -1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9932 -2.2613 -0.2868 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2989 2.0014 -0.8341 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0260 3.5299 1.2648 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7231 -2.9357 0.7063 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4764 -2.3555 1.9574 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8512 -2.1797 1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1560 2.0715 0.7953 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9356 -0.0160 1.8857 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 6 1 0 0 0 0 2 7 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 6 2 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 17 1 0 0 0 0 5 9 1 0 0 0 0 5 18 1 0 0 0 0 6 8 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 8 10 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 9 13 2 0 0 0 0 9 23 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 11 14 1 0 0 0 0 11 24 1 0 0 0 0 12 15 2 0 0 0 0 12 25 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 14 16 2 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 31 1 0 0 0 0 M END $$$$