B4LD3E -OEChem-04042105493D 26 27 0 0 0 0 0 0 0999 V2000 3.5939 -2.6085 0.0325 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1331 3.0649 -0.1265 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0533 2.2815 0.1374 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6478 0.0542 -0.5563 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2512 -0.3030 0.4893 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5524 -0.1408 0.1068 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8252 0.0811 -0.1516 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7493 1.0939 0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4478 0.7022 -0.2866 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2814 -1.2498 -0.2299 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6419 -1.5175 -0.0399 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2752 2.0550 -0.1037 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1122 0.8413 0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5415 -0.4865 0.2238 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1326 -2.9251 -0.1197 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4359 -0.9428 0.2042 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5812 -2.0558 -0.4332 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4635 3.1891 0.3079 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8131 1.6432 0.5121 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5969 -0.7039 0.3724 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0983 -3.3911 0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1623 -2.9643 -0.4912 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5216 -3.5185 -0.8085 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0114 2.6875 -0.3104 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4908 0.8652 0.2219 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4690 -0.5316 -0.0837 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 2 0 0 0 0 2 12 1 0 0 0 0 2 24 1 0 0 0 0 3 8 1 0 0 0 0 3 12 1 0 0 0 0 3 18 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 16 1 0 0 0 0 6 16 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 8 13 1 0 0 0 0 9 12 2 0 0 0 0 10 11 2 0 0 0 0 10 17 1 0 0 0 0 11 14 1 0 0 0 0 11 15 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 20 1 0 0 0 0 15 21 1 0 0 0 0 15 22 1 0 0 0 0 15 23 1 0 0 0 0 M END $$$$