53316287 -OEChem-04232417363D 65 68 0 1 0 0 0 0 0999 V2000 0.9478 -4.9612 -1.7202 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.7226 0.4066 -3.3065 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.5844 0.1859 -3.6340 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.4972 -0.6462 -1.8513 F 0 0 0 0 0 0 0 0 0 0 0 0 -5.9741 -0.8453 -0.1380 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.5305 -2.3592 -0.7312 F 0 0 0 0 0 0 0 0 0 0 0 0 -5.6176 -2.5730 1.1333 F 0 0 0 0 0 0 0 0 0 0 0 0 5.0006 -0.1936 -0.9711 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6142 -0.6371 1.2166 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8964 2.0967 0.7201 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3869 0.1200 1.9970 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0111 1.9568 2.1523 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5673 -0.5577 1.4292 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1830 1.6241 0.3723 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5269 0.3586 0.6975 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1214 1.3387 1.6203 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3875 3.3678 0.1828 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1312 -1.7438 0.5813 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1092 3.1450 -0.5766 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1275 2.5910 -0.3049 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8409 1.3036 3.0912 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8429 -0.2210 0.3736 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9982 -1.6442 -0.2264 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8643 -2.9301 0.6113 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1027 1.9408 -1.2481 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8651 4.1428 -0.6093 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9187 0.5346 2.3788 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2888 1.7346 -1.9524 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5981 -2.7310 -1.0036 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4642 -4.0170 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0512 3.9364 -1.3136 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2632 2.7323 -1.9853 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3312 -3.9175 -0.9734 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0067 1.2094 1.8251 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8305 -0.8533 2.2706 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 0.4470 -2.6699 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9183 -0.8914 1.0557 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0066 0.4966 1.1636 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8303 -1.5663 1.6093 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2411 -0.7269 -1.4461 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9858 -1.6531 0.3457 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1025 -0.9526 2.3041 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2488 4.0806 1.0053 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0716 3.8533 -0.5193 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1369 3.5544 0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1670 2.2503 -0.2971 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8381 2.7449 -1.3494 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1885 2.9341 1.9742 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2875 0.6638 3.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3186 2.0600 3.7271 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3992 -0.7440 -0.2511 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7477 -3.0237 1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6641 1.1751 -1.2868 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7111 5.0850 -0.0903 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2855 -2.6665 -1.6295 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0345 -4.9409 -0.1426 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8101 4.7129 -1.3383 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1943 2.5911 -2.5269 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0851 2.2908 1.9009 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9912 -1.3938 2.6996 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8443 1.0415 0.7376 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7522 -2.6473 1.5293 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0798 -0.1490 -1.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3304 -1.7817 -1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2492 -0.6484 -2.5365 H 0 0 0 0 0 0 0 0 0 0 0 0 1 33 1 0 0 0 0 2 36 1 0 0 0 0 3 36 1 0 0 0 0 4 36 1 0 0 0 0 5 41 1 0 0 0 0 6 41 1 0 0 0 0 7 41 1 0 0 0 0 8 22 1 0 0 0 0 8 40 1 0 0 0 0 9 22 2 0 0 0 0 10 14 1 0 0 0 0 10 16 1 0 0 0 0 10 17 1 0 0 0 0 11 13 1 0 0 0 0 11 16 2 0 0 0 0 12 16 1 0 0 0 0 12 21 1 0 0 0 0 12 48 1 0 0 0 0 13 15 1 0 0 0 0 13 18 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 22 1 0 0 0 0 17 19 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 23 2 0 0 0 0 18 24 1 0 0 0 0 19 25 2 0 0 0 0 19 26 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 27 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 23 29 1 0 0 0 0 23 51 1 0 0 0 0 24 30 2 0 0 0 0 24 52 1 0 0 0 0 25 28 1 0 0 0 0 25 53 1 0 0 0 0 26 31 2 0 0 0 0 26 54 1 0 0 0 0 27 34 2 0 0 0 0 27 35 1 0 0 0 0 28 32 2 0 0 0 0 28 36 1 0 0 0 0 29 33 2 0 0 0 0 29 55 1 0 0 0 0 30 33 1 0 0 0 0 30 56 1 0 0 0 0 31 32 1 0 0 0 0 31 57 1 0 0 0 0 32 58 1 0 0 0 0 34 38 1 0 0 0 0 34 59 1 0 0 0 0 35 39 2 0 0 0 0 35 60 1 0 0 0 0 37 38 2 0 0 0 0 37 39 1 0 0 0 0 37 41 1 0 0 0 0 38 61 1 0 0 0 0 39 62 1 0 0 0 0 40 63 1 0 0 0 0 40 64 1 0 0 0 0 40 65 1 0 0 0 0 M END > 53316287 > 1.2 > 1 49 272 259 147 237 152 3 74 151 241 31 193 60 245 83 40 154 146 208 201 183 50 214 11 207 234 97 142 226 184 248 58 82 13 89 182 68 199 139 260 32 170 52 178 244 166 81 252 268 224 22 14 246 20 257 140 176 29 159 161 120 42 174 190 261 239 197 254 262 202 135 217 258 134 266 136 156 225 215 153 223 194 158 125 264 265 43 229 230 44 238 195 23 144 163 198 204 171 65 87 228 39 263 16 247 77 73 175 124 213 206 127 191 24 17 149 121 240 167 222 181 242 64 188 177 211 51 270 112 162 212 25 203 145 71 250 235 85 126 59 33 196 99 28 109 79 232 47 160 113 105 236 70 15 205 45 48 141 269 5 173 108 165 111 63 118 8 138 12 46 255 34 101 76 219 185 38 189 218 6 169 27 253 186 9 35 2 267 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18186237312586240112 11285246 1 16684278843707899831 11578080 2 17318196934442717550 11621639 254 18191329224482100284 11828532 37 17095804442995478939 12107698 1 17749100106786537824 12156800 1 15819376630363407113 12608794 3 17912330377288327904 131258 38 17485629769908425663 13383661 66 18200891624925545182 14289585 56 18336261327246331095 15274700 242 16172272528329887754 15406563 42 17676779673244736358 20764821 26 17899974928639920210 20775438 99 17689972571336983541 35225 105 13900764213202511529 463206 1 17916308423432829923 469060 322 18198599155718016903 57527452 28 17844824769889512793 > 766.16 9.65 5.28 2.93 2.04 1.07 0.83 4.96 -0.45 0.09 2.31 -2 -0.55 1.63 > 1668.801 > 417.6 > 2 5 10 $$$$