157009755 -OEChem-03242318063D 83 86 0 1 0 0 0 0 0999 V2000 6.7824 -2.8613 -0.2633 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3675 -0.8214 -2.0943 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7672 2.0757 -1.7496 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3279 1.2653 -1.3590 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2479 0.0879 0.1817 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4845 1.0784 1.1417 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0283 1.1549 1.0188 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6265 -0.2517 0.7396 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2027 -0.2327 0.7419 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4591 0.9102 -0.3667 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6602 -0.3514 -0.9727 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6990 0.8341 -0.2803 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0166 -0.9002 -0.5304 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2732 2.4085 1.0321 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5896 2.2136 0.0523 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6937 1.9834 0.6953 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1215 2.2249 0.0065 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7995 -1.6167 0.3516 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7047 -1.1568 0.9759 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7264 0.1363 -0.7037 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2356 0.8687 -0.3992 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6835 0.0871 2.1884 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3281 -1.5925 0.2042 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7984 -0.5070 -0.7677 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.9872 1.0350 -0.7894 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.5169 -0.6318 -2.0168 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2779 0.2989 -1.2123 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.7595 -0.7692 -0.2323 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9632 -0.3067 1.2106 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9437 -2.0218 -0.7014 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9871 -0.9698 2.1868 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4110 -0.4137 1.6975 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3776 -3.2583 0.0141 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 0.7227 2.1675 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3601 1.4738 2.0156 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3216 -0.8927 1.5799 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1305 1.4455 -1.2706 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 0.4966 -1.6447 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1944 -1.1156 -1.5979 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3266 0.5551 -1.2751 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9180 -1.9781 -0.3449 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6868 -0.8139 -1.3915 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1052 3.0360 0.2192 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2251 2.9856 1.9605 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2668 3.2139 0.3626 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2053 2.0600 -0.9606 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2659 2.8502 0.3586 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1858 1.5675 1.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4422 2.9257 -0.7744 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5163 2.6208 0.9492 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3801 -1.9789 -0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5167 -2.3749 1.0938 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1529 -1.9184 0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1369 -1.6388 1.4839 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4288 -0.8926 1.7543 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9392 -0.6045 0.0669 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5119 1.5937 -1.1753 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6870 1.2193 0.5356 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3380 1.0573 2.5519 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7725 0.1047 2.2794 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3157 -0.6705 2.8905 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8011 -1.4325 1.1784 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8937 -0.4813 -0.7909 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1630 1.5490 0.1592 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2295 0.0344 -2.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4070 -1.1816 -2.3289 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7542 -1.4032 -1.9133 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1580 -0.1015 -2.2238 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4815 -3.5323 0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7142 -0.1327 -2.6868 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0103 2.6165 -1.4793 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1270 0.7929 -1.6497 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7509 0.7676 1.2612 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7504 -2.1977 -1.7594 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9502 -0.7332 1.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1607 -0.5996 3.2038 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0851 -2.0573 2.2188 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7352 -1.4482 1.8337 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0968 0.0642 0.9892 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5274 0.0925 2.6625 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5948 -4.0195 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5951 -3.1119 1.0708 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2822 -3.6549 -0.4578 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 1 69 1 0 0 0 0 2 24 1 0 0 0 0 2 70 1 0 0 0 0 3 25 1 0 0 0 0 3 71 1 0 0 0 0 4 27 1 0 0 0 0 4 72 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 14 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 36 1 0 0 0 0 9 12 1 0 0 0 0 9 18 1 0 0 0 0 9 22 1 0 0 0 0 10 16 1 0 0 0 0 10 20 1 0 0 0 0 10 37 1 0 0 0 0 11 13 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 17 1 0 0 0 0 12 21 1 0 0 0 0 12 40 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 16 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 17 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 23 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 19 53 1 0 0 0 0 19 54 1 0 0 0 0 19 55 1 0 0 0 0 20 25 1 0 0 0 0 20 26 1 0 0 0 0 20 56 1 0 0 0 0 21 24 1 0 0 0 0 21 57 1 0 0 0 0 21 58 1 0 0 0 0 22 59 1 0 0 0 0 22 60 1 0 0 0 0 22 61 1 0 0 0 0 23 24 1 0 0 0 0 23 62 1 0 0 0 0 24 63 1 0 0 0 0 25 27 1 0 0 0 0 25 64 1 0 0 0 0 26 65 1 0 0 0 0 26 66 1 0 0 0 0 26 67 1 0 0 0 0 27 28 1 0 0 0 0 27 68 1 0 0 0 0 28 29 1 0 0 0 0 28 30 2 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 29 73 1 0 0 0 0 30 33 1 0 0 0 0 30 74 1 0 0 0 0 31 75 1 0 0 0 0 31 76 1 0 0 0 0 31 77 1 0 0 0 0 32 78 1 0 0 0 0 32 79 1 0 0 0 0 32 80 1 0 0 0 0 33 81 1 0 0 0 0 33 82 1 0 0 0 0 33 83 1 0 0 0 0 M END > 157009755 > 1 > 1 188 77 101 89 88 218 13 155 161 219 129 75 65 193 201 209 62 78 35 115 79 131 182 180 16 112 148 86 215 122 31 59 74 195 168 200 9 189 56 153 171 90 164 11 176 7 44 167 104 105 205 174 34 136 186 84 211 109 80 5 54 107 150 214 149 71 23 210 103 139 207 69 142 41 202 119 106 132 25 57 53 183 121 223 95 217 102 172 43 50 192 160 206 208 63 194 48 2 123 173 212 87 24 125 45 49 39 40 221 55 187 126 82 37 130 118 198 68 170 93 165 108 22 133 111 46 116 32 92 4 163 203 120 222 151 175 73 113 216 166 27 117 97 6 33 72 18 36 177 114 70 94 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13685833 64 18059853944468499230 13690498 29 18113893876001116293 13782708 43 18334287686768391611 14294032 229 16414379778501036488 14767858 380 13262398882081169561 14856354 85 17346317141965236565 14933364 13 18186519886652597741 14955137 171 18201434822366641353 15021287 119 16200147716520979345 15064986 96 16988579995987441959 15082195 135 15285650901908474946 15142383 8 12319739142248776968 15183329 4 17203605986729240628 15352257 5 18411420630854572903 15461852 350 14779550093320827570 15510800 12 17703518684506469582 15799311 1 18339085985698408527 17844677 252 18335417976401070149 18927931 339 18040712581127216703 19841028 212 18117269260993839002 19958102 18 16660635246354224475 20105231 36 18411991251361265111 21130935 74 18059571429440355283 21150785 3 16298392365769607618 21267235 1 18272654515761290294 21315759 40 17489579087342661101 21682296 61 18411138035128151221 21781051 124 18341897415302866422 21792961 116 18338231557483021253 22149856 69 18201445813292875803 2303208 19 18341608230806527043 23081809 10 15936681580152075817 23522609 53 17915764134954326865 23559900 14 18411973685646235248 23569943 247 17130712673581568110 24771293 8 14707214335799945030 24771750 20 17975134559215128076 249057 25 13901613191383455577 25269216 80 16732990825750240187 2748736 6 8214142958193030398 3004659 81 18408877422152708112 3178227 256 18343024384735440066 335507 130 17894917359772453631 34797466 226 17458352952940122510 4073 2 17749108868382392363 4098825 35 18333730243137162932 4149490 64 18408317801447911722 4169191 19 8790880804543427191 4258327 124 16806470143999273694 44317340 157 18410009979085163268 46194498 28 17894628167547043356 465052 167 18202562891363252814 484989 97 18410295852018460778 49967989 163 15286224885152956491 504579 68 17095234826745989415 504843 32 11242265051788650737 5265222 85 17967819378825201707 54039377 194 18272653437640525630 58083652 198 17346306116389068601 59755656 215 17988358179128763550 6371009 1 11674878887841090838 6608658 132 14851598856584255207 7495541 125 18334848455010561689 9896288 288 16915398606165092521 999808 66 18409732859299859275 > 655.65 20.63 2.51 1.74 3.63 0.48 0.14 10.72 -0.63 0.01 -0.07 1.34 0 1.13 > 1356.851 > 372.5 > 2 5 10 $$$$