BBK91I -OEChem-04012113453D 31 32 0 1 0 0 0 0 0999 V2000 0.0059 -2.0330 -0.1321 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0979 1.0953 -1.2508 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9777 2.0127 0.4660 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9239 0.0987 0.3063 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0928 0.9899 0.8336 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 -0.4708 0.3364 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3691 -1.6820 -0.5692 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2974 -2.6640 -0.1509 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0728 -0.6904 0.0955 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4522 -0.2076 0.0657 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1873 0.6135 -0.1235 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7336 1.0963 -0.3538 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5005 -1.0473 0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0920 0.7140 0.0058 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0503 1.5560 -0.3837 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8171 -0.5876 0.4251 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4995 1.2064 -0.0253 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5009 -0.7563 1.3693 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3626 -2.1397 -0.5099 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2048 -1.3917 -1.6151 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2505 -3.4995 -0.8561 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4889 -3.0747 0.8464 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9381 1.7678 -0.6671 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3147 -2.0623 0.7969 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2518 2.5723 -0.7116 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6198 -1.2514 0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1308 0.6672 1.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6421 1.9447 -0.8218 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2007 0.3875 -0.2188 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7567 1.6692 0.9325 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0417 2.4980 1.3058 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 9 1 0 0 0 0 2 11 2 0 0 0 0 3 5 1 0 0 0 0 3 31 1 0 0 0 0 4 6 1 0 0 0 0 4 9 2 0 0 0 0 5 11 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 6 18 1 0 0 0 0 7 8 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 12 15 1 0 0 0 0 12 23 1 0 0 0 0 13 16 2 0 0 0 0 13 24 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 15 25 1 0 0 0 0 16 26 1 0 0 0 0 17 28 1 0 0 0 0 17 29 1 0 0 0 0 17 30 1 0 0 0 0 M END $$$$