L7TK2E -OEChem-05032300543D 77 81 0 0 0 0 0 0 0999 V2000 -4.7195 -0.5782 1.1818 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.7456 0.0388 -1.5823 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0539 -1.1410 1.0248 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8595 -1.0884 2.2416 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1620 2.6228 2.1577 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0542 -5.2751 0.2018 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8295 1.1318 1.3552 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3541 1.5026 1.2312 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5902 -3.7464 1.9083 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3360 0.5248 -0.3073 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9270 0.1564 0.9175 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1722 -0.2867 -0.9746 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8588 -0.7568 -0.3306 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2636 2.1835 2.9633 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3927 2.4256 2.0194 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6211 1.9039 1.2454 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8453 -1.3834 -1.5095 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5482 -1.2341 -0.3141 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7319 1.1259 2.4718 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5646 1.6771 2.1275 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4665 -0.4290 -1.5425 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4856 -1.8784 -1.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2771 3.4009 1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4530 -1.0557 -2.7215 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5055 2.8792 0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7635 -0.5784 -2.7379 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3335 3.6278 0.1468 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 -2.7608 -0.4931 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4162 -1.4740 -2.4773 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2333 -3.2388 -0.4773 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5362 2.2312 1.1762 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7265 -1.9520 -2.4616 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0359 2.5627 -0.1829 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 -2.8343 -1.4616 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6601 -4.1589 0.5651 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9047 1.7149 -0.8699 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6154 3.7557 -0.7708 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2827 0.3475 -2.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3531 2.0599 -2.1447 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0639 4.1008 -2.0457 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9327 3.2529 -2.7326 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1283 -2.4303 2.3442 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9964 -4.6558 2.9706 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5625 -1.0105 1.0563 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3190 -1.2795 -0.0929 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2638 3.1282 3.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6599 1.8726 3.9386 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6609 1.5737 0.9412 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0731 -1.4484 0.6384 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2052 0.1846 2.2957 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5029 0.9562 3.2306 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6499 0.9435 2.9234 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3722 3.9950 0.9356 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9550 -1.1848 -3.6786 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3213 3.0630 -0.4393 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1708 -0.3511 -3.7169 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2434 4.3872 -0.6244 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 -3.1323 0.2571 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9021 1.2252 0.3643 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1531 -0.7641 -3.2566 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4318 -1.6306 -3.2225 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1585 -3.1997 -1.4606 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9400 4.4256 -0.2453 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3052 0.7064 -2.7094 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7325 1.1622 -3.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3542 -0.5434 -3.5002 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0294 1.4319 -2.7187 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7368 5.0298 -2.5035 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2813 3.5222 -3.7254 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7106 -2.1108 3.2139 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2616 -1.6854 1.5597 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -2.5044 2.6206 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1612 -4.7801 3.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8522 -4.2226 3.4967 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2812 -5.6347 2.5773 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4422 -1.5872 1.9611 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9499 -2.1233 -0.3284 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 7 1 0 0 0 0 1 13 1 0 0 0 0 2 21 1 0 0 0 0 2 38 1 0 0 0 0 5 31 2 0 0 0 0 6 35 2 0 0 0 0 7 16 1 0 0 0 0 7 48 1 0 0 0 0 8 19 1 0 0 0 0 8 31 1 0 0 0 0 8 59 1 0 0 0 0 9 35 1 0 0 0 0 9 42 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 36 1 0 0 0 0 11 44 2 0 0 0 0 12 45 2 0 0 0 0 13 18 1 0 0 0 0 13 21 2 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 20 2 0 0 0 0 15 23 1 0 0 0 0 16 20 1 0 0 0 0 16 25 2 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 17 24 1 0 0 0 0 18 49 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 20 52 1 0 0 0 0 21 26 1 0 0 0 0 22 28 2 0 0 0 0 22 29 1 0 0 0 0 23 27 2 0 0 0 0 23 53 1 0 0 0 0 24 26 2 0 0 0 0 24 54 1 0 0 0 0 25 27 1 0 0 0 0 25 55 1 0 0 0 0 26 56 1 0 0 0 0 27 57 1 0 0 0 0 28 30 1 0 0 0 0 28 58 1 0 0 0 0 29 32 2 0 0 0 0 29 60 1 0 0 0 0 30 34 2 0 0 0 0 30 35 1 0 0 0 0 31 33 1 0 0 0 0 32 34 1 0 0 0 0 32 61 1 0 0 0 0 33 36 1 0 0 0 0 33 37 2 0 0 0 0 34 62 1 0 0 0 0 36 39 2 0 0 0 0 37 40 1 0 0 0 0 37 63 1 0 0 0 0 38 64 1 0 0 0 0 38 65 1 0 0 0 0 38 66 1 0 0 0 0 39 41 1 0 0 0 0 39 67 1 0 0 0 0 40 41 2 0 0 0 0 40 68 1 0 0 0 0 41 69 1 0 0 0 0 42 70 1 0 0 0 0 42 71 1 0 0 0 0 42 72 1 0 0 0 0 43 73 1 0 0 0 0 43 74 1 0 0 0 0 43 75 1 0 0 0 0 44 45 1 0 0 0 0 44 76 1 0 0 0 0 45 77 1 0 0 0 0 M END $$$$