B37DFS -OEChem-04022116013D 48 51 0 1 0 0 0 0 0999 V2000 0.2538 -1.4058 1.7141 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5005 0.5562 -0.0695 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4228 -2.1256 -0.5673 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.5652 -2.7172 -1.5719 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6185 -1.7070 -2.0092 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3547 -1.0873 -1.1852 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2997 -1.5148 0.6226 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3055 -1.0871 -0.8236 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6783 -0.9927 0.4281 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5787 -0.8677 -0.3392 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5916 -0.5499 -0.9803 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3410 -0.3943 1.5074 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8991 0.3924 0.1654 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4014 -1.9596 -0.0627 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2493 0.0468 0.0956 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6255 0.1216 1.3383 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0610 1.5429 -0.1076 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0422 0.5609 0.9468 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5446 -1.7914 0.7187 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8651 -0.5311 1.2235 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3029 2.3303 -1.2333 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0126 1.8628 0.7549 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4965 3.4376 -1.4964 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2061 2.9700 0.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1145 1.1523 1.0724 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4481 3.7575 -0.6338 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9784 -2.9860 -0.1743 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0713 -3.5748 -1.1071 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0352 -3.1060 -2.4493 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1646 -0.9127 -2.6129 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3528 -2.2214 -2.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7045 -1.4390 -2.1656 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8024 -0.1666 -1.3915 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0862 -0.5994 -1.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8711 -0.3158 2.4842 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1868 -2.9461 -0.4642 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0781 0.5714 2.2154 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3081 1.5359 1.3487 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1883 -2.6403 0.9295 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7559 -0.4000 1.8307 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1155 2.0944 -1.9163 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8155 1.2685 1.6431 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6847 4.0506 -2.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6094 3.2196 1.1644 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2725 0.4209 1.8723 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5574 2.0303 1.4165 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1036 1.5036 0.7608 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1799 4.6196 -0.8385 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 2 0 0 0 0 2 15 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 3 7 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 8 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 10 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 9 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 12 1 0 0 0 0 10 13 1 0 0 0 0 10 14 2 0 0 0 0 11 15 2 0 0 0 0 11 34 1 0 0 0 0 12 16 2 0 0 0 0 12 35 1 0 0 0 0 13 17 1 0 0 0 0 13 18 2 0 0 0 0 14 19 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 16 37 1 0 0 0 0 17 21 2 0 0 0 0 17 22 1 0 0 0 0 18 20 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 21 23 1 0 0 0 0 21 41 1 0 0 0 0 22 24 2 0 0 0 0 22 42 1 0 0 0 0 23 26 2 0 0 0 0 23 43 1 0 0 0 0 24 26 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 M END $$$$