D0Q7ST -OEChem-10191521532D 126130 0 1 0 0 0 0 0999 V2000 4.0402 -0.3019 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.1932 5.7762 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6635 6.4308 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3859 2.8297 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0670 1.6501 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8248 -0.6725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6101 -3.5176 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3680 -5.8402 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3570 -5.6311 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1760 -3.9085 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7356 -9.3898 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1532 -8.6853 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5670 4.5522 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4682 2.6681 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2425 0.0320 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.0114 -2.4996 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7857 -5.1357 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9722 -6.9628 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5515 8.0077 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7196 7.7665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2927 8.9736 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0867 6.7645 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0293 9.9562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8957 8.1658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0002 7.1712 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8536 8.2665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2196 6.9004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1731 6.3578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5724 4.6568 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9846 3.8478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3914 2.9342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9737 3.6387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9682 3.5342 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8036 2.1252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6373 4.2773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5509 3.8706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4464 2.8761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2103 1.2116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8091 2.2297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0615 1.7546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6226 0.4026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2213 1.4207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6493 0.9456 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6280 0.5072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6438 1.0501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2316 0.2411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0505 1.9636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8303 -0.7770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4236 -1.6905 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4290 -1.7951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0223 -2.7086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8413 -0.9860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6046 -3.4131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1924 -4.2221 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.1869 -4.1176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7747 -4.9266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3735 -5.9447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9667 -6.8582 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.7692 -4.8221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5545 -7.6672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1478 -8.5808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1657 5.5703 0.0000 B 0 0 0 0 0 0 0 0 0 0 0 0 3.7715 7.1866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0727 9.7946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7115 10.4886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6425 10.0482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9980 8.7773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5154 8.1469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7767 7.5170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7565 6.5904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9096 6.3635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6826 7.2104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5436 7.7295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3166 8.5765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1636 8.8034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4253 5.7914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6067 6.1056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9210 6.9242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8246 4.0904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4706 3.5010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5540 4.2937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9314 5.0538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9054 3.2809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8221 2.4882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6305 3.0142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1358 4.6417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9473 4.8142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7425 4.4602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1573 3.7417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0664 2.8761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5112 2.2594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8269 1.1468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5569 2.7961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8747 -0.1638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6047 1.4855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0137 0.4440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2604 1.1149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6259 -0.0328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7332 0.6055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5960 -0.2605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7300 -0.1233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4841 2.2158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3027 2.5300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6169 1.7115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0402 -1.6257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8124 -1.8599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6280 -2.4347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3397 -1.3505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4768 -0.4845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3429 -0.6216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5887 -2.9608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7701 -3.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4559 -2.4564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5758 -4.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0160 -3.5216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7442 -3.8458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1691 -5.2005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9456 -5.5226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2175 -5.1984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7145 -7.4246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9852 -7.2212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0685 -8.0139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7200 -7.5292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6078 -6.4612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9736 -5.5663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4834 -9.9562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 44 1 0 0 0 0 2 22 1 0 0 0 0 2 62 1 0 0 0 0 3 25 1 0 0 0 0 3 62 1 0 0 0 0 4 32 2 0 0 0 0 5 40 2 0 0 0 0 6 48 2 0 0 0 0 7 53 2 0 0 0 0 8 57 2 0 0 0 0 9 59 1 0 0 0 0 9125 1 0 0 0 0 10 59 2 0 0 0 0 11 61 1 0 0 0 0 11126 1 0 0 0 0 12 61 2 0 0 0 0 29 13 1 1 0 0 0 13 32 1 0 0 0 0 13 82 1 0 0 0 0 14 33 1 0 0 0 0 14 37 1 0 0 0 0 14 40 1 0 0 0 0 43 15 1 6 0 0 0 15 48 1 0 0 0 0 15 98 1 0 0 0 0 49 16 1 1 0 0 0 16 53 1 0 0 0 0 16107 1 0 0 0 0 54 17 1 6 0 0 0 17 57 1 0 0 0 0 17117 1 0 0 0 0 58 18 1 6 0 0 0 18123 1 0 0 0 0 18124 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 19 23 1 0 0 0 0 19 63 1 1 0 0 0 20 21 1 0 0 0 0 20 26 1 0 0 0 0 20 27 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 21 64 1 6 0 0 0 22 25 1 0 0 0 0 22 28 1 6 0 0 0 23 65 1 0 0 0 0 23 66 1 0 0 0 0 24 25 1 0 0 0 0 24 67 1 0 0 0 0 24 68 1 0 0 0 0 25 69 1 6 0 0 0 26 73 1 0 0 0 0 26 74 1 0 0 0 0 26 75 1 0 0 0 0 27 70 1 0 0 0 0 27 71 1 0 0 0 0 27 72 1 0 0 0 0 28 76 1 0 0 0 0 28 77 1 0 0 0 0 28 78 1 0 0 0 0 29 30 1 0 0 0 0 29 62 1 0 0 0 0 29 79 1 0 0 0 0 30 31 1 0 0 0 0 30 80 1 0 0 0 0 30 81 1 0 0 0 0 31 34 1 0 0 0 0 31 83 1 0 0 0 0 31 84 1 0 0 0 0 33 32 1 1 0 0 0 33 35 1 0 0 0 0 33 85 1 0 0 0 0 34 38 2 0 0 0 0 34 39 1 0 0 0 0 35 36 1 0 0 0 0 35 86 1 0 0 0 0 35 87 1 0 0 0 0 36 37 1 0 0 0 0 36 88 1 0 0 0 0 36 89 1 0 0 0 0 37 90 1 0 0 0 0 37 91 1 0 0 0 0 38 41 1 0 0 0 0 38 92 1 0 0 0 0 39 42 2 0 0 0 0 39 93 1 0 0 0 0 40 43 1 0 0 0 0 41 44 2 0 0 0 0 41 94 1 0 0 0 0 42 44 1 0 0 0 0 42 95 1 0 0 0 0 43 45 1 0 0 0 0 43 96 1 0 0 0 0 45 46 1 0 0 0 0 45 47 1 0 0 0 0 45 97 1 0 0 0 0 46 99 1 0 0 0 0 46100 1 0 0 0 0 46101 1 0 0 0 0 47102 1 0 0 0 0 47103 1 0 0 0 0 47104 1 0 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 49105 1 0 0 0 0 50 51 1 0 0 0 0 50 52 1 0 0 0 0 50106 1 0 0 0 0 51111 1 0 0 0 0 51112 1 0 0 0 0 51113 1 0 0 0 0 52108 1 0 0 0 0 52109 1 0 0 0 0 52110 1 0 0 0 0 53 54 1 0 0 0 0 54 55 1 0 0 0 0 54114 1 0 0 0 0 55 56 1 0 0 0 0 55115 1 0 0 0 0 55116 1 0 0 0 0 56 59 1 0 0 0 0 56118 1 0 0 0 0 56119 1 0 0 0 0 57 58 1 0 0 0 0 58 60 1 0 0 0 0 58120 1 0 0 0 0 60 61 1 0 0 0 0 60121 1 0 0 0 0 60122 1 0 0 0 0 M END $$$$