BPE8B3 -OEChem-04042105493D 65 68 0 0 0 0 0 0 0999 V2000 -2.3188 5.9403 1.0094 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9468 2.4402 -0.3002 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5267 0.6089 -1.2646 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7508 -2.0279 -1.0121 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9945 6.9566 0.2143 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5469 5.8766 2.4459 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7951 -0.3311 0.3440 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4936 0.2784 -0.5972 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8888 0.0776 -0.7624 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0524 -4.8359 -0.9378 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3148 -2.7028 -0.2898 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4274 -1.2608 -0.7317 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1365 -0.8692 0.1516 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6772 -0.4124 -0.9678 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9357 -2.5050 -0.3586 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8422 -3.9930 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1855 -1.6565 -0.5945 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3481 0.3859 -0.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6052 -1.5876 1.4144 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2981 -0.2146 -1.0363 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9604 0.9440 -0.6699 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1013 -4.3108 1.4215 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6753 4.3681 0.3385 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2447 1.8559 -0.7326 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0422 -1.0490 -0.8034 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0431 4.2484 -1.0016 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5922 3.2316 1.1431 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7772 0.7562 -0.5839 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3278 2.9924 -1.5372 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8770 1.9755 0.6076 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0123 -2.1403 1.2471 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6483 2.2646 -0.4233 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6087 -5.5751 1.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8575 -3.3527 2.5374 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5730 6.1498 0.7417 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8383 -6.4703 0.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5463 -6.0558 -0.6285 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8389 -0.0608 -0.0862 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1401 -1.5754 -0.6874 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2606 -3.3228 -0.1146 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3352 -0.2873 -1.7083 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0379 1.2065 -1.0768 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2627 -1.8003 -0.5436 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5938 -0.8985 2.2677 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9220 -2.4114 1.6542 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9181 0.7405 -1.3874 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7969 0.3008 1.1449 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1076 5.1193 -1.6477 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3051 3.3008 2.1885 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6118 2.9043 -2.5822 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8239 1.1093 1.2617 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3295 -2.6520 2.1612 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0559 -2.8594 0.4228 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7276 -1.3376 1.0417 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 0.9963 -0.3925 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3135 3.1092 -0.3119 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8305 -5.8781 2.7196 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7991 -3.0770 2.5877 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4634 -2.4493 2.4126 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1232 -3.7866 3.5078 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 7.1212 1.1471 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0361 5.3538 1.2612 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3714 6.1182 -0.3307 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2333 -7.4610 0.8543 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7075 -6.7164 -1.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 2 0 0 0 0 1 6 2 0 0 0 0 1 23 1 0 0 0 0 1 35 1 0 0 0 0 2 28 1 0 0 0 0 2 32 1 0 0 0 0 3 14 1 0 0 0 0 3 24 1 0 0 0 0 4 25 2 0 0 0 0 7 13 1 0 0 0 0 7 18 1 0 0 0 0 7 47 1 0 0 0 0 8 25 1 0 0 0 0 8 28 1 0 0 0 0 8 55 1 0 0 0 0 9 21 1 0 0 0 0 9 28 2 0 0 0 0 10 16 1 0 0 0 0 10 37 2 0 0 0 0 11 15 2 0 0 0 0 11 16 1 0 0 0 0 11 17 1 0 0 0 0 12 15 1 0 0 0 0 12 20 2 0 0 0 0 12 25 1 0 0 0 0 13 19 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 17 2 0 0 0 0 14 20 1 0 0 0 0 15 40 1 0 0 0 0 16 22 2 0 0 0 0 17 43 1 0 0 0 0 18 21 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 31 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 21 32 2 0 0 0 0 22 33 1 0 0 0 0 22 34 1 0 0 0 0 23 26 2 0 0 0 0 23 27 1 0 0 0 0 24 29 2 0 0 0 0 24 30 1 0 0 0 0 26 29 1 0 0 0 0 26 48 1 0 0 0 0 27 30 2 0 0 0 0 27 49 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 32 56 1 0 0 0 0 33 36 2 0 0 0 0 33 57 1 0 0 0 0 34 58 1 0 0 0 0 34 59 1 0 0 0 0 34 60 1 0 0 0 0 35 61 1 0 0 0 0 35 62 1 0 0 0 0 35 63 1 0 0 0 0 36 37 1 0 0 0 0 36 64 1 0 0 0 0 37 65 1 0 0 0 0 M END $$$$