BK3EC0 -OEChem-04022106443D 57 59 0 0 0 0 0 0 0999 V2000 4.5894 2.5326 -1.4840 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9701 -3.4738 -0.1129 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1992 -2.9886 0.6175 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3472 2.7951 0.4338 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0785 -0.8238 -1.1987 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7806 3.4597 0.6870 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7522 1.5599 1.6399 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6124 0.5990 -0.0052 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4704 -0.3439 0.1669 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6104 0.7446 1.1927 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4956 0.0412 -1.1738 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1845 2.0594 -0.4125 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3041 -0.1725 -0.5753 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2217 -1.0510 -0.4235 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3137 -2.1137 0.4852 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5644 -1.3972 1.0689 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4934 -2.2783 1.2288 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9341 -1.6172 -1.0801 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9521 -2.7929 -0.1375 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1656 -1.3808 -1.9094 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2611 -4.1047 1.5533 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7835 2.3674 1.7108 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9519 4.1430 0.0334 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1240 -0.4794 -1.1924 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0437 0.9023 -1.3657 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0954 -1.0216 -0.3509 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9349 1.7419 -0.6976 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9866 -0.1820 0.3173 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9064 1.1998 0.1439 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8357 2.0755 0.8401 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1079 0.9519 2.1408 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2045 -0.1655 1.3368 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3149 1.5661 1.0145 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3696 0.6775 -1.3581 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9285 -0.0171 -2.1111 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8614 -0.9685 -0.9503 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2163 0.6338 -1.3001 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4583 -1.5717 1.6592 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6097 -3.0886 1.9428 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6434 -2.3294 -2.1784 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8661 -0.9252 -2.8621 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6681 -4.6819 1.5406 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0797 -4.7737 1.2704 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4091 -3.7227 2.5681 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6927 2.4341 1.6488 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0445 1.3542 1.9963 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1397 3.0478 2.4904 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8630 4.1731 -0.0696 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4014 4.4465 -0.9151 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2649 4.8470 0.8104 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2900 1.3368 -2.0172 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1809 -2.0952 -0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8281 2.8075 -0.8673 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7326 -0.6370 0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4368 4.0543 1.1827 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1114 3.9363 0.0957 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3042 2.3291 2.0353 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 2 0 0 0 0 2 19 2 0 0 0 0 3 15 1 0 0 0 0 3 19 1 0 0 0 0 3 21 1 0 0 0 0 4 12 1 0 0 0 0 4 22 1 0 0 0 0 4 23 1 0 0 0 0 5 14 1 0 0 0 0 5 18 2 0 0 0 0 6 30 1 0 0 0 0 6 55 1 0 0 0 0 6 56 1 0 0 0 0 7 30 2 0 0 0 0 7 57 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 9 13 2 0 0 0 0 9 16 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 15 17 1 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 20 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 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 25 27 1 0 0 0 0 25 51 1 0 0 0 0 26 28 2 0 0 0 0 26 52 1 0 0 0 0 27 29 2 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 M END $$$$