L1XJO6 -OEChem-05032300582D 166173 0 1 0 0 0 0 0999 V2000 21.5469 -4.5459 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.2531 4.4736 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 23.5812 -8.0694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.5599 -5.5342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2566 2.2407 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5852 5.2179 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2536 4.4404 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9244 1.4964 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9974 5.1414 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6388 -1.8933 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6173 -1.6871 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2852 -2.4314 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.0867 -7.0989 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 23.4880 -6.2899 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.2027 -3.8394 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -1.6823 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6353 0.3396 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6103 2.7788 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2601 0.0078 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5743 -1.2746 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4678 5.3146 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1989 5.3721 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3831 3.8442 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 21.8788 -6.1207 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 22.7448 -5.6207 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 21.1418 -5.4536 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 22.5356 -4.6489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1633 -5.6599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.0812 -7.2034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4954 -4.9156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5169 -5.1218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8491 -4.3775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8706 -4.5837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -0.0728 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9889 0.8777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -0.8775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.3775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 1.0839 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7320 -1.3776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2242 -4.0456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.1225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 2.0344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.8776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5564 -3.3013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9209 3.7293 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0000 -0.3775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.3776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8030 3.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6138 0.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5779 -3.5075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2816 -0.1985 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.6520 3.7867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9100 -2.7632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9710 -1.1490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9315 -2.9694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6188 4.7862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9065 -0.5303 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.9280 -0.7365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2637 -2.2252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2171 0.4202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8959 6.1684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7826 3.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3282 -2.8438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1957 0.6264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8744 6.3746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3111 2.7093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2280 6.9127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7832 3.5251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9960 -3.5881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3500 4.8436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8635 -0.1179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5063 1.5769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1851 7.3251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8401 1.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5387 7.8632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3122 2.6430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5172 8.0694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8406 1.7940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6853 -4.5386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9745 -3.3819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8420 0.0883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4848 1.7832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1527 1.0388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3532 -5.2829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6423 -4.1262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3317 -5.0767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1421 -6.5448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.4804 -5.1948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.7522 -4.9713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.1521 -4.5829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.5347 -4.0289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.6369 -5.9875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.3945 -6.2351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.6718 -7.5596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.0944 -6.1610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.0218 -4.5879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2642 -4.3403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9906 -5.4494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7482 -5.6970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3754 -4.0498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6178 -3.8022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2908 0.0234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9684 1.4974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3751 0.9651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7227 -1.2923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7227 -0.4628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7748 0.4946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3953 -3.2501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8709 -2.2716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6979 -4.3732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4555 -4.6209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.7425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4427 -0.2497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.4976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3142 3.6014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0827 -2.9737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3251 -2.7261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0036 2.6509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.0675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.6876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4205 2.7704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2171 2.7968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0515 -3.8352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8091 -4.0828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6957 -0.6599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8833 3.2115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2587 3.9146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4364 -2.4356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6788 -2.1880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4240 -0.8570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5884 -1.6369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4528 0.5971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4052 -3.2971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1628 -3.5447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3876 5.3614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0122 4.6583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7139 -1.1196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1810 -1.1468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1966 1.0398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6033 0.5075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7812 -2.5518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9456 -3.3317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2885 5.9131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9307 2.7299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6214 6.7848 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4555 4.0514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6709 -0.7072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0923 2.0384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7917 7.4530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1677 1.3008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1246 8.3247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6925 2.6224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7098 8.6588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5486 1.2471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0787 -4.6665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1671 -2.7926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2561 -0.3731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6774 2.3725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7458 5.0800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1783 5.9917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9300 3.5522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8568 3.5165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7593 1.1667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1606 -5.8722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2490 -3.9983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7457 -5.5382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 6 1 0 0 0 0 2 7 1 0 0 0 0 2 9 2 0 0 0 0 2 45 1 0 0 0 0 3 29 2 0 0 0 0 4 33 2 0 0 0 0 5 42 2 0 0 0 0 6 61 1 0 0 0 0 7 62 1 0 0 0 0 8 49 2 0 0 0 0 10 54 1 0 0 0 0 10 63 1 0 0 0 0 11 58 2 0 0 0 0 12 59 2 0 0 0 0 13 24 1 0 0 0 0 13 29 1 0 0 0 0 13 94 1 0 0 0 0 14 25 1 0 0 0 0 14 29 1 0 0 0 0 14 95 1 0 0 0 0 15 33 1 0 0 0 0 15 40 1 0 0 0 0 15108 1 0 0 0 0 16 36 1 0 0 0 0 16 39 1 0 0 0 0 16109 1 0 0 0 0 38 17 1 1 0 0 0 17 49 1 0 0 0 0 17113 1 0 0 0 0 18 42 1 0 0 0 0 45 18 1 6 0 0 0 18118 1 0 0 0 0 51 19 1 1 0 0 0 19 58 1 0 0 0 0 19132 1 0 0 0 0 57 20 1 1 0 0 0 20 59 1 0 0 0 0 20138 1 0 0 0 0 21 56 1 0 0 0 0 21 70 2 0 0 0 0 22 70 1 0 0 0 0 22159 1 0 0 0 0 22160 1 0 0 0 0 23 70 1 0 0 0 0 23161 1 0 0 0 0 23162 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 87 1 1 0 0 0 25 27 1 0 0 0 0 25 88 1 1 0 0 0 26 28 1 1 0 0 0 26 89 1 0 0 0 0 27 90 1 0 0 0 0 27 91 1 0 0 0 0 28 30 1 0 0 0 0 28 92 1 0 0 0 0 28 93 1 0 0 0 0 30 31 1 0 0 0 0 30 96 1 0 0 0 0 30 97 1 0 0 0 0 31 32 1 0 0 0 0 31 98 1 0 0 0 0 31 99 1 0 0 0 0 32 33 1 0 0 0 0 32100 1 0 0 0 0 32101 1 0 0 0 0 34 35 1 6 0 0 0 34 36 1 0 0 0 0 34 37 1 0 0 0 0 34102 1 0 0 0 0 35 38 1 0 0 0 0 35103 1 0 0 0 0 35104 1 0 0 0 0 36105 1 0 0 0 0 36106 1 0 0 0 0 37 39 1 0 0 0 0 37 41 2 0 0 0 0 38 42 1 0 0 0 0 38107 1 0 0 0 0 39 43 2 0 0 0 0 40 44 1 0 0 0 0 40110 1 0 0 0 0 40111 1 0 0 0 0 41 46 1 0 0 0 0 41112 1 0 0 0 0 43 47 1 0 0 0 0 43114 1 0 0 0 0 44 50 1 0 0 0 0 44116 1 0 0 0 0 44117 1 0 0 0 0 45 48 1 0 0 0 0 45115 1 0 0 0 0 46 47 2 0 0 0 0 46119 1 0 0 0 0 47120 1 0 0 0 0 48 52 1 0 0 0 0 48121 1 0 0 0 0 48122 1 0 0 0 0 49 51 1 0 0 0 0 50 53 1 0 0 0 0 50123 1 0 0 0 0 50124 1 0 0 0 0 51 54 1 0 0 0 0 51125 1 0 0 0 0 52 56 1 0 0 0 0 52126 1 0 0 0 0 52127 1 0 0 0 0 53 55 1 0 0 0 0 53128 1 0 0 0 0 53129 1 0 0 0 0 54130 1 0 0 0 0 54131 1 0 0 0 0 55 59 1 0 0 0 0 55133 1 0 0 0 0 55134 1 0 0 0 0 56135 1 0 0 0 0 56136 1 0 0 0 0 57 58 1 0 0 0 0 57 60 1 0 0 0 0 57137 1 0 0 0 0 60 64 1 0 0 0 0 60139 1 0 0 0 0 60140 1 0 0 0 0 61 65 2 0 0 0 0 61 67 1 0 0 0 0 62 66 2 0 0 0 0 62 68 1 0 0 0 0 63 69 1 0 0 0 0 63141 1 0 0 0 0 63142 1 0 0 0 0 64 71 2 0 0 0 0 64 72 1 0 0 0 0 65 73 1 0 0 0 0 65143 1 0 0 0 0 66 74 1 0 0 0 0 66144 1 0 0 0 0 67 75 2 0 0 0 0 67145 1 0 0 0 0 68 76 2 0 0 0 0 68146 1 0 0 0 0 69 79 2 0 0 0 0 69 80 1 0 0 0 0 71 81 1 0 0 0 0 71147 1 0 0 0 0 72 82 2 0 0 0 0 72148 1 0 0 0 0 73 77 2 0 0 0 0 73149 1 0 0 0 0 74 78 2 0 0 0 0 74150 1 0 0 0 0 75 77 1 0 0 0 0 75151 1 0 0 0 0 76 78 1 0 0 0 0 76152 1 0 0 0 0 77153 1 0 0 0 0 78154 1 0 0 0 0 79 84 1 0 0 0 0 79155 1 0 0 0 0 80 85 2 0 0 0 0 80156 1 0 0 0 0 81 83 2 0 0 0 0 81157 1 0 0 0 0 82 83 1 0 0 0 0 82158 1 0 0 0 0 83163 1 0 0 0 0 84 86 2 0 0 0 0 84164 1 0 0 0 0 85 86 1 0 0 0 0 85165 1 0 0 0 0 86166 1 0 0 0 0 M END $$$$