B3LN1R -OEChem-04022115543D 46 47 0 1 0 0 0 0 0999 V2000 3.7288 2.4424 1.2126 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2004 0.9239 -2.0981 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4344 0.9665 2.1100 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6283 0.2050 0.0653 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4892 2.2851 -0.2540 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7784 -0.6117 0.9654 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4766 -2.1046 0.7222 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0595 0.3532 0.0142 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8771 -2.5590 -0.6819 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2048 -2.9554 1.7666 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3724 1.7953 0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8058 0.5076 -1.0121 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3481 0.3260 -0.7906 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3891 -0.0155 -0.3745 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4918 0.0473 -1.8688 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1807 0.4340 0.4957 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8603 -0.1234 -1.6608 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5493 0.2633 0.7037 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8088 -0.1921 -0.1588 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4452 0.4808 0.8842 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5408 -1.0363 -0.9938 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8138 0.3097 1.0922 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9094 -1.2074 -0.7858 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5459 -0.5345 0.2573 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8613 -0.4421 0.8958 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5028 -0.3642 2.0001 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4010 -2.2806 0.8459 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3895 0.1843 -1.0173 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7253 -3.6375 -0.7991 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2737 -2.0637 -1.4485 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9317 -2.3427 -0.8835 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9706 -4.0173 1.6357 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9022 -2.6707 2.7798 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2909 -2.8361 1.6902 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2331 -0.1391 0.9337 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 -0.0383 -2.8782 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4324 0.6756 1.3587 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8159 3.2303 -0.0829 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0252 1.7314 -0.9146 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4789 -0.3093 -2.5345 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9116 0.3326 1.7257 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9170 1.1703 1.5378 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0833 -1.6048 -1.7988 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4786 -1.8701 -1.4311 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6123 -0.6778 0.4098 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3784 0.7320 2.1069 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 2 0 0 0 0 2 12 2 0 0 0 0 3 22 1 0 0 0 0 3 46 1 0 0 0 0 4 8 1 0 0 0 0 4 12 1 0 0 0 0 4 35 1 0 0 0 0 5 11 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 7 27 1 0 0 0 0 8 11 1 0 0 0 0 8 28 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 12 13 1 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 14 17 2 0 0 0 0 14 18 1 0 0 0 0 14 19 1 0 0 0 0 15 17 1 0 0 0 0 15 36 1 0 0 0 0 16 18 2 0 0 0 0 16 37 1 0 0 0 0 17 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 20 42 1 0 0 0 0 21 23 2 0 0 0 0 21 43 1 0 0 0 0 22 24 2 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 45 1 0 0 0 0 M END $$$$