LK2R9I -OEChem-05032301152D 48 52 0 1 0 0 0 0 0999 V2000 2.0000 -3.6914 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4249 3.1145 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4374 3.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5984 -0.8851 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5984 -3.1321 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8213 2.0166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5733 1.3574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7682 2.3382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8405 2.2115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1112 1.5359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2395 2.0258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1228 0.5360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2626 0.0260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3793 1.5159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2742 -0.9739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3909 0.5159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3802 -1.5086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6235 -1.1076 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7610 3.7366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1896 -2.0086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3802 -2.5086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1803 -1.4878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.3258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6235 -2.9096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2742 -3.0433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1803 -2.5294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7806 2.6352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2518 0.8273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1512 1.1328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3880 2.3248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6738 2.9510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6633 0.2322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8388 1.8196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8576 0.1998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8283 -0.5224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2177 4.1559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3417 4.1932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3044 3.3172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7364 -0.2807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7049 -1.6220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7049 -2.3952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7160 -1.1757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4847 0.0608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6134 0.1589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5153 -0.7124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7364 -3.7366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2670 -3.6632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7160 -2.8415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 2 0 0 0 0 2 3 1 0 0 0 0 2 9 2 0 0 0 0 3 11 1 0 0 0 0 3 19 1 0 0 0 0 4 17 1 0 0 0 0 4 18 1 0 0 0 0 4 39 1 0 0 0 0 5 21 1 0 0 0 0 5 24 1 0 0 0 0 5 46 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 14 16 2 0 0 0 0 14 33 1 0 0 0 0 15 17 2 0 0 0 0 15 22 1 0 0 0 0 16 34 1 0 0 0 0 17 21 1 0 0 0 0 18 20 1 0 0 0 0 18 23 1 1 0 0 0 18 35 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 24 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 25 2 0 0 0 0 22 26 2 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 M END $$$$