B0SH2B -OEChem-04012114532D 31 33 0 0 0 0 0 0 0999 V2000 7.2622 -2.9198 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 0.0802 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 -1.4198 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8757 2.6077 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 -0.4198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 -1.4198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 0.0802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5961 -0.3990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5022 0.1149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5022 -1.9544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.1044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5961 -1.4406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 -1.9198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 -0.4198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7359 1.1044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 -0.3923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8718 1.6077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.1111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0038 1.1111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6607 0.5552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8636 0.5552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5094 0.7349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5094 -2.5744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0604 -1.7526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6651 -1.7298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2740 1.4123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8617 -1.0123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4619 -0.1969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4681 1.4231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3399 2.9198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4138 2.9156 0.0000 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 $$$$