BKWE20 -OEChem-04022113163D 83 89 0 0 0 0 0 0 0999 V2000 -9.8324 -5.0317 -0.3638 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8386 0.8082 -2.3436 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6662 -0.1071 2.3233 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9446 -1.9511 -1.0309 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2598 -1.7196 -0.1692 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3258 1.4601 0.0726 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1757 0.7624 0.0262 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0967 3.7495 0.2375 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2354 5.3213 0.3608 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9531 4.6238 0.3184 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2032 0.2584 0.0474 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1717 -1.3170 1.5464 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9542 -0.4455 -2.4491 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.5057 -2.4802 -0.2283 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6503 0.7234 0.0171 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1607 -0.8067 -1.3162 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1643 -0.9888 1.1019 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8338 -0.0432 -1.3019 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8374 -0.2323 1.2058 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5638 -3.3081 -1.5154 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6508 -3.3962 0.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8042 -4.1948 -1.5199 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8863 -4.2778 0.8475 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1426 2.8073 0.1723 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7732 3.0059 0.1926 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2339 1.7093 0.0996 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3261 4.3194 0.2909 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8416 1.3377 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5454 4.9789 0.3301 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1588 1.2482 -1.1311 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1767 1.0678 1.2781 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 0.8890 -1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 0.7083 1.2611 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8539 0.6191 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4086 -0.4435 0.8191 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0065 -0.0730 1.1456 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4202 -1.4423 0.9797 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4448 -0.6172 -0.1467 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1691 0.0070 -0.2352 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4737 1.9943 -2.8165 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5183 -2.2149 1.3741 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6218 -0.5591 -0.9192 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7298 -2.0095 2.7395 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7279 -1.3267 -0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6749 -2.1409 0.5926 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9467 -1.2721 -1.3295 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3617 -1.7889 -0.2296 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4122 1.5114 0.0756 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9968 -0.0953 -1.3301 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1636 -1.3421 -2.2692 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1601 -1.6630 1.9628 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0019 -0.2897 1.2232 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0052 -0.7484 -1.4495 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8010 0.6567 -2.1459 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8067 0.3330 2.1453 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0089 -0.9518 1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6709 -3.9425 -1.5892 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6196 -2.6909 -2.4163 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7761 -2.8401 1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7638 -4.0360 1.0844 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7228 -3.5976 -1.5601 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7941 -4.8448 -2.4006 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9360 -4.9880 1.6791 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8071 -3.6827 0.8654 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2460 5.8050 0.3878 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6699 1.4570 -2.0688 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6955 1.1353 2.2316 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2526 3.8989 0.2673 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6712 5.5923 0.3903 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6108 0.5226 2.2302 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6296 0.2103 -0.8749 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8573 0.7141 -0.9924 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9767 1.7607 -3.7588 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2213 2.3489 -2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7310 2.7769 -3.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4952 -2.8506 2.2522 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6009 0.0908 -1.7837 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7201 -1.2955 3.5668 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7336 -2.4233 2.5621 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4020 -2.8365 2.9738 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5329 -2.7379 0.8939 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1899 0.1356 -2.7671 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7909 -0.3957 -3.0222 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 32 1 0 0 0 0 2 40 1 0 0 0 0 3 36 2 0 0 0 0 4 46 2 0 0 0 0 5 14 1 0 0 0 0 5 16 1 0 0 0 0 5 17 1 0 0 0 0 6 7 1 0 0 0 0 6 15 1 0 0 0 0 6 24 1 0 0 0 0 7 26 2 0 0 0 0 8 24 2 0 0 0 0 8 29 1 0 0 0 0 9 27 1 0 0 0 0 9 29 2 0 0 0 0 10 27 1 0 0 0 0 10 68 1 0 0 0 0 10 69 1 0 0 0 0 11 34 1 0 0 0 0 11 36 1 0 0 0 0 11 71 1 0 0 0 0 12 35 1 0 0 0 0 12 37 1 0 0 0 0 12 43 1 0 0 0 0 13 46 1 0 0 0 0 13 82 1 0 0 0 0 13 83 1 0 0 0 0 14 20 1 0 0 0 0 14 21 1 0 0 0 0 14 47 1 0 0 0 0 15 18 1 0 0 0 0 15 19 1 0 0 0 0 15 48 1 0 0 0 0 16 18 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 17 19 1 0 0 0 0 17 51 1 0 0 0 0 17 52 1 0 0 0 0 18 53 1 0 0 0 0 18 54 1 0 0 0 0 19 55 1 0 0 0 0 19 56 1 0 0 0 0 20 22 1 0 0 0 0 20 57 1 0 0 0 0 20 58 1 0 0 0 0 21 23 1 0 0 0 0 21 59 1 0 0 0 0 21 60 1 0 0 0 0 22 61 1 0 0 0 0 22 62 1 0 0 0 0 23 63 1 0 0 0 0 23 64 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 26 28 1 0 0 0 0 28 30 2 0 0 0 0 28 31 1 0 0 0 0 29 65 1 0 0 0 0 30 32 1 0 0 0 0 30 66 1 0 0 0 0 31 33 2 0 0 0 0 31 67 1 0 0 0 0 32 34 2 0 0 0 0 33 34 1 0 0 0 0 33 70 1 0 0 0 0 35 36 1 0 0 0 0 35 39 2 0 0 0 0 37 38 2 0 0 0 0 37 41 1 0 0 0 0 38 39 1 0 0 0 0 38 42 1 0 0 0 0 39 72 1 0 0 0 0 40 73 1 0 0 0 0 40 74 1 0 0 0 0 40 75 1 0 0 0 0 41 45 2 0 0 0 0 41 76 1 0 0 0 0 42 44 2 0 0 0 0 42 77 1 0 0 0 0 43 78 1 0 0 0 0 43 79 1 0 0 0 0 43 80 1 0 0 0 0 44 45 1 0 0 0 0 44 46 1 0 0 0 0 45 81 1 0 0 0 0 M END $$$$