B21XUF -OEChem-04022117583D 57 58 0 1 0 0 0 0 0999 V2000 -2.4373 -0.0741 0.8132 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7610 1.2107 0.5679 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7504 0.2627 0.3440 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.2423 -1.1721 0.3865 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.8128 1.0833 -0.9122 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7103 -1.9015 -0.8085 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5930 0.6706 1.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9188 2.3320 -0.8856 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7392 -3.0321 -0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3728 -2.5474 0.0109 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4695 1.9776 -1.0782 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4279 2.2684 -0.2745 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9310 1.6606 -0.5661 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5253 -2.1304 -0.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2548 0.5446 0.4384 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1136 -2.6327 1.4906 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2282 -0.4719 -0.1153 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6798 -0.0864 -0.0161 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8694 -1.6428 -0.6797 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5011 3.1275 0.9563 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3014 -0.0094 -1.4049 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4294 -1.0769 0.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1088 1.6396 0.6924 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6491 -1.8390 1.1366 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8512 1.4134 -1.0457 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5907 0.4796 -1.7986 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5658 -2.3395 -1.3366 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2233 -1.2189 -1.5136 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4198 0.0462 2.4026 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6542 0.5956 1.2605 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3837 1.7078 1.7997 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0964 2.8913 0.0362 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2105 2.9868 -1.7157 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6059 -3.6719 -1.3239 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1828 -3.6794 0.3259 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2774 1.3545 -1.9514 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 1.2631 -1.5895 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6972 2.4445 -0.5365 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2571 -2.1808 -1.9583 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3231 0.0376 0.7093 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6004 0.9582 1.3939 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8026 -1.9837 2.0392 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9048 -2.3442 1.7651 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2598 -3.6610 1.8382 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6277 -2.3040 -1.0931 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4161 2.5126 1.8576 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4268 3.7030 1.0259 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3184 3.8544 0.9565 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9291 0.8604 -1.9603 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1035 -0.8991 -2.0124 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3938 0.0717 -1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1556 -0.9526 1.9219 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2334 -2.1197 0.5931 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5173 -0.9650 0.8022 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0725 2.6262 1.1683 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6045 1.7993 -0.2676 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7068 1.0164 1.3605 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 2 18 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 4 6 1 0 0 0 0 4 24 1 0 0 0 0 5 8 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 6 9 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 11 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 14 2 0 0 0 0 10 16 1 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 13 15 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 19 1 0 0 0 0 14 39 1 0 0 0 0 15 17 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 18 21 1 0 0 0 0 18 22 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 23 57 1 0 0 0 0 M END $$$$