B7JRB3 -OEChem-04012113053D 29 30 0 0 0 0 0 0 0999 V2000 -1.9923 -2.9237 0.0004 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2452 -0.4892 -0.0281 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1022 2.3613 1.2096 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1844 2.5109 -1.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9239 -0.6816 -0.0036 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2778 0.5775 -0.0184 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1475 -1.8518 0.0023 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1256 0.6291 -0.0266 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3272 -0.7334 0.0044 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2458 -1.7818 -0.0057 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8813 -0.5438 -0.0203 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0828 0.4394 -0.0016 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0544 1.7477 -0.0243 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4477 1.6776 -0.0157 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7859 -3.2090 0.0176 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5727 0.3670 0.0094 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8430 1.9039 -0.0425 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8588 -1.6820 0.0139 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5997 2.7354 -0.0362 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0249 2.5984 -0.0221 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0668 -4.0336 0.0217 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4094 -3.3457 -0.8727 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4008 -3.3296 0.9162 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0168 1.2962 0.3822 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9189 -0.4394 0.6649 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9474 0.1860 -1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9334 -2.6768 -0.0069 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5599 0.4284 -0.0356 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5832 3.2160 1.1944 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 27 1 0 0 0 0 2 11 1 0 0 0 0 2 28 1 0 0 0 0 3 17 1 0 0 0 0 3 29 1 0 0 0 0 4 17 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 5 9 1 0 0 0 0 6 8 2 0 0 0 0 6 13 1 0 0 0 0 7 10 1 0 0 0 0 7 15 1 0 0 0 0 8 11 1 0 0 0 0 8 17 1 0 0 0 0 9 12 2 0 0 0 0 9 18 1 0 0 0 0 10 11 2 0 0 0 0 12 14 1 0 0 0 0 12 16 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 16 24 1 0 0 0 0 16 25 1 0 0 0 0 16 26 1 0 0 0 0 M END $$$$