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noname 0.1416 116 C106 12.3307 30.0597 3.8070 C.2 1 noname 0.1406 117 C107 -11.9744 34.8589 11.6905 C.2 1 noname 0.1406 118 C108 22.1564 49.9840 -13.7294 C.3 1 noname -0.0654 119 C109 -10.0443 21.0434 38.6139 C.3 1 noname -0.0654 120 C110 15.0185 46.0266 24.3928 C.3 1 noname -0.0654 121 H1 0.3477 33.8683 7.2216 H 1 noname 0.0266 122 H2 1.3151 33.1694 8.4864 H 1 noname 0.0266 123 H3 -0.9929 31.7934 7.0064 H 1 noname 0.0266 124 H4 -0.0410 31.0117 8.2702 H 1 noname 0.0266 125 H5 1.0579 32.1169 5.6165 H 1 noname 0.0266 126 H6 2.0474 31.3411 6.8549 H 1 noname 0.0266 127 H7 -1.7032 33.5448 8.6115 H 1 noname 0.0266 128 H8 -0.7450 32.8009 9.8933 H 1 noname 0.0266 129 H9 15.1420 40.4616 -6.5158 H 1 noname 0.0266 130 H10 16.7040 40.0392 -5.7742 H 1 noname 0.0266 131 H11 -9.6300 29.5600 27.6956 H 1 noname 0.0266 132 H12 -8.8383 28.2228 26.8277 H 1 noname 0.0266 133 H13 16.1327 40.1673 -8.7698 H 1 noname 0.0266 134 H14 17.6947 39.7449 -8.0282 H 1 noname 0.0266 135 H15 -11.4972 28.0512 28.3169 H 1 noname 0.0266 136 H16 -10.7054 26.7140 27.4490 H 1 noname 0.0266 137 H17 15.0576 38.2358 -7.6055 H 1 noname 0.0266 138 H18 16.6195 37.8134 -6.8639 H 1 noname 0.0266 139 H19 -11.5959 29.3690 26.1965 H 1 noname 0.0266 140 H20 -10.8042 28.0318 25.3286 H 1 noname 0.0266 141 H21 2.3982 34.1910 5.8303 H 1 noname 0.0266 142 H22 3.3945 33.4542 7.0876 H 1 noname 0.0266 143 H23 -3.0444 31.4714 8.3965 H 1 noname 0.0266 144 H24 -2.0924 30.6881 9.6601 H 1 noname 0.0266 145 H25 16.2172 42.3931 -7.6801 H 1 noname 0.0266 146 H26 17.7792 41.9707 -6.9385 H 1 noname 0.0266 147 H27 14.4536 38.4380 12.8167 H 1 noname 0.0266 148 H28 14.8330 37.0402 13.8513 H 1 noname 0.0266 149 H29 -9.5312 28.2422 29.8160 H 1 noname 0.0266 150 H30 -8.7395 26.9050 28.9481 H 1 noname 0.0266 151 H31 12.5477 39.0146 14.2945 H 1 noname 0.0266 152 H32 12.9272 37.6168 15.3291 H 1 noname 0.0266 153 H33 14.0669 38.5300 -5.3515 H 1 noname 0.0266 154 H34 15.6289 38.1077 -4.6098 H 1 noname 0.0266 155 H35 12.2133 37.4835 12.3486 H 1 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noname 0.0266 196 H76 19.8450 43.6080 -10.3568 H 1 noname 0.0266 197 H77 -11.2996 25.4157 32.5577 H 1 noname 0.0266 198 H78 -10.5079 24.0785 31.6898 H 1 noname 0.0266 199 H79 -13.4518 28.1442 1.2690 H 1 noname 0.0266 200 H80 -13.0771 26.7282 2.2803 H 1 noname 0.0266 201 H81 -11.2968 29.1817 1.9234 H 1 noname 0.0266 202 H82 -10.9221 27.7656 2.9346 H 1 noname 0.0266 203 H83 -11.4246 27.7093 -0.0911 H 1 noname 0.0266 204 H84 -11.0499 26.2932 0.9202 H 1 noname 0.0266 205 H85 13.2166 42.0767 18.1862 H 1 noname 0.0266 206 H86 13.5960 40.6789 19.2209 H 1 noname 0.0266 207 H87 -13.3240 29.6167 3.2835 H 1 noname 0.0266 208 H88 -12.9493 28.2006 4.2948 H 1 noname 0.0266 209 H89 5.1588 32.8088 2.8346 H 1 noname 0.0266 210 H90 6.1531 31.9912 4.0645 H 1 noname 0.0266 211 H91 12.9072 34.3727 -5.2769 H 1 noname 0.0266 212 H92 14.4692 33.9504 -4.5352 H 1 noname 0.0266 213 H93 -11.7935 32.0046 21.9557 H 1 noname 0.0266 214 H94 -11.0017 30.6674 21.0878 H 1 noname 0.0266 215 H95 -5.8233 32.8752 11.3662 H 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33.5134 21.3344 H 1 noname 0.0266 236 H116 -9.1346 32.1762 20.4665 H 1 noname 0.0266 237 H117 6.3996 34.8902 3.1318 H 1 noname 0.0267 238 H118 7.4240 34.1689 4.4105 H 1 noname 0.0267 239 H119 -7.0864 30.8020 11.0835 H 1 noname 0.0267 240 H120 -6.1321 29.9780 12.3522 H 1 noname 0.0267 241 H121 -13.7075 25.1994 -2.7598 H 1 noname 0.0269 242 H122 -13.3328 23.7833 -1.7486 H 1 noname 0.0269 243 H123 13.4503 33.8448 6.9791 H 1 noname 0.0266 244 H124 13.8297 32.4470 8.0137 H 1 noname 0.0266 245 H125 -11.0411 32.1266 5.9523 H 1 noname 0.0266 246 H126 -10.6664 30.7105 6.9635 H 1 noname 0.0266 247 H127 19.3582 45.9619 -12.2628 H 1 noname 0.0266 248 H128 20.9202 45.5395 -11.5211 H 1 noname 0.0266 249 H129 -11.2008 24.0979 34.6781 H 1 noname 0.0266 250 H130 -10.4091 22.7607 33.8102 H 1 noname 0.0266 251 H131 13.5510 43.6078 20.1321 H 1 noname 0.0266 252 H132 13.9304 42.2100 21.1667 H 1 noname 0.0266 253 H133 -11.6803 24.7644 -4.1200 H 1 noname 0.0297 254 H134 11.8321 32.4412 -4.1126 H 1 noname 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H174 12.3685 30.1622 -2.1807 H 1 noname 0.0372 295 H175 -11.2573 33.1945 15.2122 H 1 noname 0.0639 296 H176 8.5565 31.9549 0.6521 H 1 noname 0.0374 297 H177 9.7179 32.3108 -0.6577 H 1 noname 0.0374 298 H178 -11.9910 34.6402 17.7149 H 1 noname 0.0372 299 H179 -11.1993 33.3030 16.8470 H 1 noname 0.0372 300 H180 -9.2428 32.4702 16.2586 H 1 noname 0.0374 301 H181 -8.3164 32.9734 14.7848 H 1 noname 0.0374 302 H182 -10.4131 22.6623 -3.7677 H 1 noname 0.0233 303 H183 -11.4090 22.3017 -2.3371 H 1 noname 0.0233 304 H184 -10.3221 23.7113 -2.3325 H 1 noname 0.0233 305 H185 -12.4648 22.6714 -5.1936 H 1 noname 0.0233 306 H186 -13.8353 23.7269 -4.7743 H 1 noname 0.0233 307 H187 -13.4606 22.3109 -3.7630 H 1 noname 0.0233 308 H188 10.8757 31.3593 4.5652 H 1 noname 0.0372 309 H189 11.2551 29.9615 5.5998 H 1 noname 0.0372 310 H190 20.5178 50.1192 -12.3374 H 1 noname 0.0264 311 H191 22.0798 49.6968 -11.5957 H 1 noname 0.0264 312 H192 -9.1362 22.9711 38.2976 H 1 noname 0.0264 313 H193 -8.3444 21.6339 37.4297 H 1 noname 0.0264 314 H194 -10.7854 35.0715 9.9812 H 1 noname 0.0372 315 H195 -10.4108 33.6554 10.9924 H 1 noname 0.0372 316 H196 16.1256 46.0934 22.5460 H 1 noname 0.0264 317 H197 16.5050 44.6956 23.5806 H 1 noname 0.0264 318 H198 9.9164 30.5642 2.8615 H 1 noname 0.0600 319 H199 10.9239 32.0381 2.9664 H 1 noname 0.0600 320 H200 -10.7050 32.7572 12.7991 H 1 noname 0.0600 321 H201 -9.6267 34.1382 12.7747 H 1 noname 0.0600 322 H202 22.4062 51.0422 -13.6529 H 1 noname 0.0230 323 H203 21.5085 49.8250 -14.5914 H 1 noname 0.0230 324 H204 23.0705 49.4026 -13.8498 H 1 noname 0.0230 325 H205 -9.4461 20.8237 39.4981 H 1 noname 0.0230 326 H206 -11.0033 21.4623 38.9189 H 1 noname 0.0230 327 H207 -10.2115 20.1251 38.0510 H 1 noname 0.0230 328 H208 15.7467 46.6275 24.9376 H 1 noname 0.0230 329 H209 14.2198 46.6700 24.0238 H 1 noname 0.0230 330 H210 14.5992 45.2722 25.0585 H 1 noname 0.0230 @BOND 1 1 97 1 2 1 114 1 3 2 99 1 4 2 115 1 5 3 112 1 6 3 116 1 7 4 113 1 8 4 117 1 9 5 105 2 10 6 106 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329 1 329 120 330 1 @SUBSTRUCTURE 1 noname 1