B0SH2B -OEChem-04022101353D 31 33 0 0 0 0 0 0 0999 V2000 -3.7342 2.3515 -0.2613 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9129 -2.0401 0.3953 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2870 0.1428 0.0663 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4189 1.3361 0.7867 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5741 -0.5128 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9553 0.8195 -0.1108 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5728 -1.6138 0.2488 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7568 0.1630 -0.1143 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 -0.8308 0.0575 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9888 1.8192 -0.2837 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1617 -0.1831 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3653 1.4877 -0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3846 1.1843 -0.1111 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0205 -1.2035 0.2451 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1077 0.7385 0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5701 -1.4389 -0.5649 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4619 0.4044 0.3334 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9245 -1.7728 -0.5657 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8703 -0.8512 -0.1164 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4451 -2.3493 -0.5546 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3811 -2.1065 1.2097 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0674 -1.8702 0.2247 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2720 2.8589 -0.4254 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0758 2.2921 -0.4539 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2694 0.4038 0.0653 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8210 1.7139 0.7198 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8741 -2.1772 -0.9535 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2438 -2.7476 -0.9228 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9228 -1.1229 -0.1235 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4007 1.0935 0.7871 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1244 2.2467 1.1136 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 2 0 0 0 0 2 14 2 0 0 0 0 3 13 1 0 0 0 0 3 14 1 0 0 0 0 3 25 1 0 0 0 0 4 17 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 6 10 1 0 0 0 0 6 13 1 0 0 0 0 7 14 1 0 0 0 0 7 20 1 0 0 0 0 7 21 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 9 22 1 0 0 0 0 10 12 2 0 0 0 0 10 23 1 0 0 0 0 11 15 2 0 0 0 0 11 16 1 0 0 0 0 12 24 1 0 0 0 0 15 17 1 0 0 0 0 15 26 1 0 0 0 0 16 18 2 0 0 0 0 16 27 1 0 0 0 0 17 19 2 0 0 0 0 18 19 1 0 0 0 0 18 28 1 0 0 0 0 19 29 1 0 0 0 0 M END $$$$