B8LKE2 -OEChem-04022103573D 38 40 0 0 0 0 0 0 0999 V2000 -1.3652 3.6280 0.0136 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9038 -0.3484 0.0276 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1129 0.8637 0.0110 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2340 -0.2795 -0.0113 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1203 2.0567 -0.0063 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2012 -1.5517 0.0056 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5131 -0.3416 0.0145 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6795 0.8488 0.0373 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6030 -1.4668 -0.0076 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1478 0.5259 0.0136 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5521 -2.7986 0.0094 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3262 -2.6571 -0.0167 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4548 0.8210 -0.0018 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2996 -3.9721 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8443 0.3566 1.2102 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8134 0.3956 -1.2052 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6882 -3.9009 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2065 0.0571 1.1881 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1755 0.0961 -1.2274 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8721 -0.0730 -0.0308 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5561 3.3338 0.0014 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6163 4.4063 -0.0123 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4539 1.4503 0.9273 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4356 1.4770 -0.8293 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3281 -1.1507 0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5287 -2.9000 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4142 -2.6287 -0.0272 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8024 -4.9373 -0.0001 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3365 0.4535 2.1661 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2816 0.5233 -2.1443 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2791 -4.8122 -0.0211 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7488 -0.0752 2.1197 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6938 -0.0058 -2.1764 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1349 1.9865 -0.0169 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9327 -0.3064 -0.0482 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1458 5.3929 0.0218 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2104 4.3273 -0.9271 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2688 4.2953 0.8585 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 2 0 0 0 0 2 7 1 0 0 0 0 2 8 1 0 0 0 0 2 25 1 0 0 0 0 3 7 2 0 0 0 0 3 13 1 0 0 0 0 4 9 1 0 0 0 0 4 13 2 0 0 0 0 5 13 1 0 0 0 0 5 21 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 11 2 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 12 2 0 0 0 0 10 15 2 0 0 0 0 10 16 1 0 0 0 0 11 14 1 0 0 0 0 11 26 1 0 0 0 0 12 17 1 0 0 0 0 12 27 1 0 0 0 0 14 17 2 0 0 0 0 14 28 1 0 0 0 0 15 18 1 0 0 0 0 15 29 1 0 0 0 0 16 19 2 0 0 0 0 16 30 1 0 0 0 0 17 31 1 0 0 0 0 18 20 2 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 M END $$$$