1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 137 138 139 140 141 142 143 144 145 146 147 148 149 150 151 152 153 154 155 156 157 158 159 160 161 162 163 164 165 166 167 168 169 170 171 172 173 174 175 176 177 178 179 180 181 182 183 184 185 186 187 188 189 190 191 192 193 194 195 196 197 198 199 200 201 202 203 204 205 206 207 208 209 210 211 212 213 214 215 216 217 218 219 220 221 222 223 224 225 226 227 228 229 230 231 232 233 234 235 236 237 238 239 240 241 242 243 244 245 246 247 248 249 250 251 252 253 254 255 256 257 258 259 260 261 262 263 264 265 266 267 268 269 270 271 272 273 274 275 276 277 278 279 280 281 282 283 284 285 286 287 288 289 290 291 292 293 294 295 296 297 298 299 300 301 302 303 304 305 306 307 308 309 310 311 312 313 314 315 316 317 318 319 320 321 322 323 324 325 326 327 328 329 330 331 332 333 334 335 336 337 338 339 340 341 342 343 344 345 346 347 348 349 350 351 352 353 354 355 356 357 358 359 360 361 362 363 364 365 366 367 368 369 370 371 372 373 374 375 376 377 378 379 380 381 382 383 384 385 386 387 388 389 390 391 392 393 394 395 396 397 398 399 400 401 402 403 404 405 406 407 408 409 410 411 412 413 414 415 416 417 418 419 420 421 422 423 424 425 426 427 428 429 430 431 432 433 434 435 436 437 438 439 440 441 442 443 444 445 446 447 448 449 450 451 452 453 454 455 456 457 458 459 460 461 462 463 464 465 466 467 468 469 470 471 472 473 474 475 476 477 478 479 480 481 482 483 484 485 486 487 488 489 490 491 492 493 494 495 496 497 498 499 500 501 502 503 504 505 506 507 508 509 510 511 512 513 514 515 516 517 518 519 520 521 522 523 524 525 526 527 528 529 530 531 532 533 534 535 536 537 538 539 540 541 542 543 544 545 546 547 548 549 550 551 552 553 554 555 556 557 558 559 560 561 562 563 564 565 566 567 568 569 570 571 572 573 574 575 576 577 578 579 580 581 582 583 584 585 586 587 588 589 590 591 592 593 594 595 596 597 598 599 600 601 602 603 604 605 606 607 608 609 610 611 612 613 614 615 616 617 618 619 620 621 622 623 624 625 626 627 628 629 630 631 632 633 634 635 636 637 638 639 640 641 642 643 644 645 646 647 648 649 650 651 652 653 654 655 656 657 658 659 660 661 662 663 664 665 666 667 668 669 670 671 672 673 674 675 676 677 678 679 680 681 682 683 684 685 686 687 688 689 690 691 692
|
CRYST1 59.446 61.825 66.459 90.00 90.00 90.00 1
ATOM 1 C12 OL 1 32.043 9.558 43.219 1.00 0.00 C
ATOM 2 H2R OL 1 31.040 9.944 43.415 1.00 0.00 H
ATOM 3 H2S OL 1 31.958 8.476 43.111 1.00 0.00 H
ATOM 4 C13 OL 1 32.602 10.178 41.919 1.00 0.00 C
ATOM 5 H3R OL 1 33.535 9.677 41.649 1.00 0.00 H
ATOM 6 H3S OL 1 32.844 11.228 42.093 1.00 0.00 H
ATOM 7 C14 OL 1 31.609 10.099 40.739 1.00 0.00 C
ATOM 8 H4R OL 1 30.665 10.569 41.018 1.00 0.00 H
ATOM 9 H4S OL 1 31.392 9.056 40.504 1.00 0.00 H
ATOM 10 C15 OL 1 32.213 10.793 39.497 1.00 0.00 C
ATOM 11 H5R OL 1 32.417 10.052 38.721 1.00 0.00 H
ATOM 12 H5S OL 1 33.172 11.227 39.767 1.00 0.00 H
ATOM 13 C16 OL 1 31.348 11.933 38.924 1.00 0.00 C
ATOM 14 H6R OL 1 31.953 12.474 38.193 1.00 0.00 H
ATOM 15 H6S OL 1 31.084 12.643 39.710 1.00 0.00 H
ATOM 16 C17 OL 1 30.079 11.405 38.230 1.00 0.00 C
ATOM 17 H7R OL 1 29.339 11.101 38.974 1.00 0.00 H
ATOM 18 H7S OL 1 30.339 10.521 37.646 1.00 0.00 H
ATOM 19 C18 OL 1 29.482 12.466 37.285 1.00 0.00 C
ATOM 20 H8R OL 1 29.088 13.295 37.875 1.00 0.00 H
ATOM 21 H8S OL 1 30.271 12.883 36.657 1.00 0.00 H
ATOM 22 C19 OL 1 28.376 11.873 36.436 1.00 0.00 C
ATOM 23 H9R OL 1 27.386 11.904 36.886 1.00 0.00 H
ATOM 24 C110 OL 1 28.520 11.348 35.222 1.00 0.00 C
ATOM 25 H10R OL 1 27.645 10.957 34.707 1.00 0.00 H
ATOM 26 C111 OL 1 29.820 11.238 34.453 1.00 0.00 C
ATOM 27 H11R OL 1 30.529 11.998 34.777 1.00 0.00 H
ATOM 28 H11S OL 1 29.629 11.428 33.394 1.00 0.00 H
ATOM 29 C112 OL 1 30.435 9.831 34.609 1.00 0.00 C
ATOM 30 H12R OL 1 29.766 9.101 34.148 1.00 0.00 H
ATOM 31 H12S OL 1 30.521 9.568 35.665 1.00 0.00 H
ATOM 32 C113 OL 1 31.821 9.734 33.945 1.00 0.00 C
ATOM 33 H13R OL 1 32.087 8.682 33.817 1.00 0.00 H
ATOM 34 H13S OL 1 31.764 10.171 32.946 1.00 0.00 H
ATOM 35 C114 OL 1 32.925 10.419 34.784 1.00 0.00 C
ATOM 36 H14R OL 1 32.572 11.361 35.209 1.00 0.00 H
ATOM 37 H14S OL 1 33.189 9.770 35.622 1.00 0.00 H
ATOM 38 C115 OL 1 34.177 10.685 33.928 1.00 0.00 C
ATOM 39 H15R OL 1 34.375 9.816 33.296 1.00 0.00 H
ATOM 40 H15S OL 1 35.049 10.814 34.573 1.00 0.00 H
ATOM 41 C116 OL 1 34.002 11.936 33.044 1.00 0.00 C
ATOM 42 H16R OL 1 32.994 11.989 32.625 1.00 0.00 H
ATOM 43 H16S OL 1 34.676 11.846 32.199 1.00 0.00 H
ATOM 44 C117 OL 1 34.313 13.229 33.823 1.00 0.00 C
ATOM 45 H17R OL 1 33.475 13.473 34.480 1.00 0.00 H
ATOM 46 H17S OL 1 35.199 13.096 34.448 1.00 0.00 H
ATOM 47 C118 OL 1 34.563 14.398 32.865 1.00 0.00 C
ATOM 48 H18R OL 1 34.629 15.333 33.423 1.00 0.00 H
ATOM 49 H18S OL 1 33.757 14.465 32.136 1.00 0.00 H
ATOM 50 H18T OL 1 35.491 14.280 32.309 1.00 0.00 H
ATOM 51 C11 PC 2 32.919 9.871 44.416 1.00 0.00 C
ATOM 52 O12 PC 2 33.893 10.604 44.374 1.00 0.00 O
ATOM 53 O11 PC 2 32.466 9.274 45.545 1.00 0.00 O
ATOM 54 C1 PC 2 33.314 9.282 46.733 1.00 0.00 C
ATOM 55 HR PC 2 33.988 10.145 46.743 1.00 0.00 H
ATOM 56 HS PC 2 32.676 9.340 47.619 1.00 0.00 H
ATOM 57 C2 PC 2 34.114 7.967 46.804 1.00 0.00 C
ATOM 58 HX PC 2 33.407 7.143 46.943 1.00 0.00 H
ATOM 59 C3 PC 2 35.135 7.998 47.966 1.00 0.00 C
ATOM 60 HA PC 2 35.582 7.008 48.106 1.00 0.00 H
ATOM 61 HB PC 2 35.930 8.709 47.726 1.00 0.00 H
ATOM 62 O31 PC 2 34.471 8.412 49.192 1.00 0.00 O
ATOM 63 P31 PC 2 35.319 8.625 50.530 1.00 0.00 P
ATOM 64 O32 PC 2 34.435 9.734 51.250 1.00 0.00 O
ATOM 65 C31 PC 2 33.189 9.350 51.872 1.00 0.00 C
ATOM 66 H1A PC 2 32.366 9.539 51.180 1.00 0.00 H
ATOM 67 H1B PC 2 33.201 8.279 52.103 1.00 0.00 H
ATOM 68 C32 PC 2 33.019 10.121 53.199 1.00 0.00 C
ATOM 69 H2A PC 2 32.091 9.802 53.672 1.00 0.00 H
ATOM 70 H2B PC 2 33.838 9.855 53.866 1.00 0.00 H
ATOM 71 N31 PC 2 32.965 11.631 53.174 1.00 0.00 N
ATOM 72 C33 PC 2 34.332 12.209 52.939 1.00 0.00 C
ATOM 73 H3A PC 2 34.267 13.298 52.992 1.00 0.00 H
ATOM 74 H3B PC 2 34.997 11.831 53.718 1.00 0.00 H
ATOM 75 H3C PC 2 34.687 11.888 51.960 1.00 0.00 H
ATOM 76 C34 PC 2 32.013 12.101 52.117 1.00 0.00 C
ATOM 77 H4A PC 2 31.017 11.715 52.337 1.00 0.00 H
ATOM 78 H4B PC 2 31.996 13.190 52.115 1.00 0.00 H
ATOM 79 H4C PC 2 32.357 11.725 51.153 1.00 0.00 H
ATOM 80 C35 PC 2 32.477 12.121 54.508 1.00 0.00 C
ATOM 81 H5A PC 2 32.441 13.212 54.487 1.00 0.00 H
ATOM 82 H5B PC 2 33.168 11.773 55.280 1.00 0.00 H
ATOM 83 H5C PC 2 31.482 11.711 54.685 1.00 0.00 H
ATOM 84 O33 PC 2 35.418 7.405 51.361 1.00 0.00 O
ATOM 85 O34 PC 2 36.701 9.099 50.314 1.00 0.00 O
ATOM 86 O21 PC 2 34.825 7.789 45.549 1.00 0.00 O
ATOM 87 C21 PC 2 35.226 6.551 45.184 1.00 0.00 C
ATOM 88 O22 PC 2 34.980 5.544 45.826 1.00 0.00 O
ATOM 89 C12 OL2 3 35.955 6.540 43.858 1.00 0.00 C
ATOM 90 H2R OL2 3 36.358 5.543 43.670 1.00 0.00 H
ATOM 91 H2S OL2 3 36.801 7.224 43.931 1.00 0.00 H
ATOM 92 C13 OL2 3 35.083 6.995 42.668 1.00 0.00 C
ATOM 93 H3R OL2 3 35.740 7.161 41.812 1.00 0.00 H
ATOM 94 H3S OL2 3 34.612 7.953 42.898 1.00 0.00 H
ATOM 95 C14 OL2 3 34.004 5.954 42.293 1.00 0.00 C
ATOM 96 H4R OL2 3 33.306 5.854 43.128 1.00 0.00 H
ATOM 97 H4S OL2 3 34.465 4.977 42.137 1.00 0.00 H
ATOM 98 C15 OL2 3 33.210 6.370 41.032 1.00 0.00 C
ATOM 99 H5R OL2 3 32.896 7.407 41.142 1.00 0.00 H
ATOM 100 H5S OL2 3 32.298 5.772 40.966 1.00 0.00 H
ATOM 101 C16 OL2 3 34.004 6.224 39.712 1.00 0.00 C
ATOM 102 H6R OL2 3 35.012 6.629 39.820 1.00 0.00 H
ATOM 103 H6S OL2 3 33.503 6.819 38.945 1.00 0.00 H
ATOM 104 C17 OL2 3 34.062 4.758 39.230 1.00 0.00 C
ATOM 105 H7R OL2 3 33.042 4.384 39.122 1.00 0.00 H
ATOM 106 H7S OL2 3 34.564 4.131 39.971 1.00 0.00 H
ATOM 107 C18 OL2 3 34.778 4.627 37.871 1.00 0.00 C
ATOM 108 H8R OL2 3 34.380 5.369 37.176 1.00 0.00 H
ATOM 109 H8S OL2 3 34.538 3.647 37.453 1.00 0.00 H
ATOM 110 C19 OL2 3 36.286 4.729 38.000 1.00 0.00 C
ATOM 111 H9R OL2 3 36.759 3.883 38.494 1.00 0.00 H
ATOM 112 C110 OL2 3 37.053 5.699 37.513 1.00 0.00 C
ATOM 113 H10R OL2 3 38.132 5.636 37.642 1.00 0.00 H
ATOM 114 C111 OL2 3 36.561 6.971 36.855 1.00 0.00 C
ATOM 115 H11R OL2 3 37.328 7.742 36.952 1.00 0.00 H
ATOM 116 H11S OL2 3 35.679 7.344 37.380 1.00 0.00 H
ATOM 117 C112 OL2 3 36.216 6.788 35.365 1.00 0.00 C
ATOM 118 H12R OL2 3 35.864 7.749 34.981 1.00 0.00 H
ATOM 119 H12S OL2 3 35.391 6.081 35.262 1.00 0.00 H
ATOM 120 C113 OL2 3 37.409 6.308 34.509 1.00 0.00 C
ATOM 121 H13R OL2 3 37.734 5.313 34.820 1.00 0.00 H
ATOM 122 H13S OL2 3 38.251 6.988 34.651 1.00 0.00 H
ATOM 123 C114 OL2 3 36.995 6.286 33.024 1.00 0.00 C
ATOM 124 H14R OL2 3 36.320 7.125 32.849 1.00 0.00 H
ATOM 125 H14S OL2 3 36.441 5.373 32.809 1.00 0.00 H
ATOM 126 C115 OL2 3 38.201 6.397 32.069 1.00 0.00 C
ATOM 127 H15R OL2 3 38.826 5.506 32.163 1.00 0.00 H
ATOM 128 H15S OL2 3 38.817 7.243 32.366 1.00 0.00 H
ATOM 129 C116 OL2 3 37.787 6.579 30.589 1.00 0.00 C
ATOM 130 H16R OL2 3 37.322 5.661 30.224 1.00 0.00 H
ATOM 131 H16S OL2 3 38.692 6.741 29.999 1.00 0.00 H
ATOM 132 C117 OL2 3 36.819 7.766 30.366 1.00 0.00 C
ATOM 133 H17R OL2 3 37.183 8.652 30.891 1.00 0.00 H
ATOM 134 H17S OL2 3 35.834 7.520 30.770 1.00 0.00 H
ATOM 135 C118 OL2 3 36.662 8.096 28.872 1.00 0.00 C
ATOM 136 H18R OL2 3 36.332 7.216 28.317 1.00 0.00 H
ATOM 137 H18S OL2 3 37.610 8.441 28.454 1.00 0.00 H
ATOM 138 H18T OL2 3 35.920 8.886 28.740 1.00 0.00 H
ATOM 139 C12 OL 85 32.103 18.891 43.993 1.00 0.00 C
ATOM 140 H2R OL 85 31.377 19.328 43.330 1.00 0.00 H
ATOM 141 H2S OL 85 33.039 19.427 43.877 1.00 0.00 H
ATOM 142 C13 OL 85 32.249 17.448 43.509 1.00 0.00 C
ATOM 143 H3R OL 85 31.543 17.261 42.700 1.00 0.00 H
ATOM 144 H3S OL 85 31.985 16.788 44.317 1.00 0.00 H
ATOM 145 C14 OL 85 33.684 17.183 43.018 1.00 0.00 C
ATOM 146 H4R OL 85 33.906 17.824 42.160 1.00 0.00 H
ATOM 147 H4S OL 85 34.367 17.452 43.823 1.00 0.00 H
ATOM 148 C15 OL 85 33.940 15.709 42.671 1.00 0.00 C
ATOM 149 H5R OL 85 33.077 15.118 42.954 1.00 0.00 H
ATOM 150 H5S OL 85 34.778 15.350 43.270 1.00 0.00 H
ATOM 151 C16 OL 85 34.253 15.491 41.181 1.00 0.00 C
ATOM 152 H6R OL 85 33.417 15.836 40.575 1.00 0.00 H
ATOM 153 H6S OL 85 35.132 16.077 40.902 1.00 0.00 H
ATOM 154 C17 OL 85 34.517 13.996 40.916 1.00 0.00 C
ATOM 155 H7R OL 85 35.276 13.641 41.614 1.00 0.00 H
ATOM 156 H7S OL 85 33.608 13.421 41.106 1.00 0.00 H
ATOM 157 C18 OL 85 35.002 13.735 39.479 1.00 0.00 C
ATOM 158 H8R OL 85 35.757 14.474 39.208 1.00 0.00 H
ATOM 159 H8S OL 85 34.156 13.849 38.797 1.00 0.00 H
ATOM 160 C19 OL 85 35.560 12.329 39.386 1.00 0.00 C
ATOM 161 H9R OL 85 35.045 11.589 39.991 1.00 0.00 H
ATOM 162 C110 OL 85 36.652 11.949 38.733 1.00 0.00 C
ATOM 163 H10R OL 85 36.966 10.910 38.804 1.00 0.00 H
ATOM 164 C111 OL 85 37.519 12.829 37.859 1.00 0.00 C
ATOM 165 H11R OL 85 38.398 13.126 38.433 1.00 0.00 H
ATOM 166 H11S OL 85 36.994 13.741 37.571 1.00 0.00 H
ATOM 167 C112 OL 85 37.987 12.104 36.581 1.00 0.00 C
ATOM 168 H12R OL 85 38.638 12.783 36.027 1.00 0.00 H
ATOM 169 H12S OL 85 37.122 11.887 35.950 1.00 0.00 H
ATOM 170 C113 OL 85 38.756 10.796 36.882 1.00 0.00 C
ATOM 171 H13R OL 85 38.050 10.003 37.140 1.00 0.00 H
ATOM 172 H13S OL 85 39.394 10.955 37.749 1.00 0.00 H
ATOM 173 C114 OL 85 39.653 10.339 35.711 1.00 0.00 C
ATOM 174 H14R OL 85 40.216 9.454 36.013 1.00 0.00 H
ATOM 175 H14S OL 85 40.373 11.127 35.487 1.00 0.00 H
ATOM 176 C115 OL 85 38.825 10.010 34.456 1.00 0.00 C
ATOM 177 H15R OL 85 38.159 9.177 34.682 1.00 0.00 H
ATOM 178 H15S OL 85 38.185 10.856 34.226 1.00 0.00 H
ATOM 179 C116 OL 85 39.681 9.648 33.218 1.00 0.00 C
ATOM 180 H16R OL 85 40.291 8.768 33.432 1.00 0.00 H
ATOM 181 H16S OL 85 38.992 9.381 32.415 1.00 0.00 H
ATOM 182 C117 OL 85 40.581 10.794 32.706 1.00 0.00 C
ATOM 183 H17R OL 85 41.418 10.955 33.373 1.00 0.00 H
ATOM 184 H17S OL 85 40.039 11.728 32.699 1.00 0.00 H
ATOM 185 C118 OL 85 41.084 10.521 31.277 1.00 0.00 C
ATOM 186 H18R OL 85 41.707 11.349 30.933 1.00 0.00 H
ATOM 187 H18S OL 85 41.673 9.604 31.238 1.00 0.00 H
ATOM 188 H18T OL 85 40.242 10.418 30.589 1.00 0.00 H
ATOM 189 C11 PC 86 31.612 19.110 45.405 1.00 0.00 C
ATOM 190 O12 PC 86 30.757 18.425 45.929 1.00 0.00 O
ATOM 191 O11 PC 86 32.166 20.208 45.969 1.00 0.00 O
ATOM 192 C1 PC 86 31.564 20.826 47.147 1.00 0.00 C
ATOM 193 HR PC 86 31.662 21.911 47.035 1.00 0.00 H
ATOM 194 HS PC 86 30.501 20.574 47.187 1.00 0.00 H
ATOM 195 C2 PC 86 32.230 20.430 48.486 1.00 0.00 C
ATOM 196 HX PC 86 32.363 19.346 48.567 1.00 0.00 H
ATOM 197 C3 PC 86 31.428 20.982 49.680 1.00 0.00 C
ATOM 198 HA PC 86 31.942 20.781 50.623 1.00 0.00 H
ATOM 199 HB PC 86 31.374 22.065 49.578 1.00 0.00 H
ATOM 200 O31 PC 86 30.087 20.440 49.723 1.00 0.00 O
ATOM 201 P31 PC 86 29.820 19.069 50.477 1.00 0.00 P
ATOM 202 O32 PC 86 28.788 19.478 51.618 1.00 0.00 O
ATOM 203 C31 PC 86 29.214 20.252 52.756 1.00 0.00 C
ATOM 204 H1A PC 86 30.297 20.406 52.740 1.00 0.00 H
ATOM 205 H1B PC 86 28.725 21.230 52.702 1.00 0.00 H
ATOM 206 C32 PC 86 28.768 19.515 54.036 1.00 0.00 C
ATOM 207 H2A PC 86 28.792 20.213 54.873 1.00 0.00 H
ATOM 208 H2B PC 86 27.738 19.171 53.916 1.00 0.00 H
ATOM 209 N31 PC 86 29.575 18.310 54.478 1.00 0.00 N
ATOM 210 C33 PC 86 31.030 18.652 54.633 1.00 0.00 C
ATOM 211 H3A PC 86 31.427 18.918 53.651 1.00 0.00 H
ATOM 212 H3B PC 86 31.113 19.494 55.322 1.00 0.00 H
ATOM 213 H3C PC 86 31.549 17.776 55.027 1.00 0.00 H
ATOM 214 C34 PC 86 29.450 17.173 53.510 1.00 0.00 C
ATOM 215 H4A PC 86 29.955 16.300 53.927 1.00 0.00 H
ATOM 216 H4B PC 86 28.390 16.972 53.351 1.00 0.00 H
ATOM 217 H4C PC 86 29.925 17.459 52.575 1.00 0.00 H
ATOM 218 C35 PC 86 29.037 17.849 55.801 1.00 0.00 C
ATOM 219 H5A PC 86 29.666 17.040 56.171 1.00 0.00 H
ATOM 220 H5B PC 86 28.016 17.494 55.650 1.00 0.00 H
ATOM 221 H5C PC 86 29.045 18.692 56.495 1.00 0.00 H
ATOM 222 O33 PC 86 29.241 18.044 49.589 1.00 0.00 O
ATOM 223 O34 PC 86 31.057 18.449 51.013 1.00 0.00 O
ATOM 224 O21 PC 86 33.481 21.136 48.621 1.00 0.00 O
ATOM 225 C21 PC 86 34.612 20.640 48.108 1.00 0.00 C
ATOM 226 O22 PC 86 34.722 19.529 47.614 1.00 0.00 O
ATOM 227 C12 OL2 87 35.752 21.623 48.219 1.00 0.00 C
ATOM 228 H2R OL2 87 36.376 21.370 49.077 1.00 0.00 H
ATOM 229 H2S OL2 87 35.356 22.630 48.374 1.00 0.00 H
ATOM 230 C13 OL2 87 36.563 21.580 46.923 1.00 0.00 C
ATOM 231 H3R OL2 87 35.874 21.757 46.093 1.00 0.00 H
ATOM 232 H3S OL2 87 36.975 20.579 46.794 1.00 0.00 H
ATOM 233 C14 OL2 87 37.707 22.606 46.853 1.00 0.00 C
ATOM 234 H4R OL2 87 38.457 22.415 47.625 1.00 0.00 H
ATOM 235 H4S OL2 87 37.311 23.616 46.987 1.00 0.00 H
ATOM 236 C15 OL2 87 38.312 22.451 45.451 1.00 0.00 C
ATOM 237 H5R OL2 87 37.472 22.450 44.758 1.00 0.00 H
ATOM 238 H5S OL2 87 38.813 21.483 45.371 1.00 0.00 H
ATOM 239 C16 OL2 87 39.277 23.561 45.015 1.00 0.00 C
ATOM 240 H6R OL2 87 40.212 23.479 45.566 1.00 0.00 H
ATOM 241 H6S OL2 87 38.846 24.539 45.239 1.00 0.00 H
ATOM 242 C17 OL2 87 39.554 23.440 43.499 1.00 0.00 C
ATOM 243 H7R OL2 87 39.923 22.439 43.265 1.00 0.00 H
ATOM 244 H7S OL2 87 40.349 24.133 43.231 1.00 0.00 H
ATOM 245 C18 OL2 87 38.280 23.733 42.675 1.00 0.00 C
ATOM 246 H8R OL2 87 37.694 24.489 43.202 1.00 0.00 H
ATOM 247 H8S OL2 87 37.659 22.843 42.618 1.00 0.00 H
ATOM 248 C19 OL2 87 38.563 24.265 41.292 1.00 0.00 C
ATOM 249 H9R OL2 87 38.885 25.303 41.284 1.00 0.00 H
ATOM 250 C110 OL2 87 38.436 23.637 40.126 1.00 0.00 C
ATOM 251 H10R OL2 87 38.688 24.195 39.229 1.00 0.00 H
ATOM 252 C111 OL2 87 38.016 22.202 39.866 1.00 0.00 C
ATOM 253 H11R OL2 87 37.709 21.709 40.787 1.00 0.00 H
ATOM 254 H11S OL2 87 38.874 21.648 39.483 1.00 0.00 H
ATOM 255 C112 OL2 87 36.885 22.093 38.815 1.00 0.00 C
ATOM 256 H12R OL2 87 35.974 22.518 39.232 1.00 0.00 H
ATOM 257 H12S OL2 87 36.684 21.037 38.619 1.00 0.00 H
ATOM 258 C113 OL2 87 37.221 22.799 37.480 1.00 0.00 C
ATOM 259 H13R OL2 87 38.101 22.336 37.042 1.00 0.00 H
ATOM 260 H13S OL2 87 37.477 23.838 37.661 1.00 0.00 H
ATOM 261 C114 OL2 87 36.051 22.737 36.474 1.00 0.00 C
ATOM 262 H14R OL2 87 35.136 23.105 36.944 1.00 0.00 H
ATOM 263 H14S OL2 87 35.884 21.693 36.208 1.00 0.00 H
ATOM 264 C115 OL2 87 36.324 23.548 35.182 1.00 0.00 C
ATOM 265 H15R OL2 87 35.570 23.287 34.438 1.00 0.00 H
ATOM 266 H15S OL2 87 37.295 23.267 34.772 1.00 0.00 H
ATOM 267 C116 OL2 87 36.249 25.071 35.435 1.00 0.00 C
ATOM 268 H16R OL2 87 36.967 25.347 36.203 1.00 0.00 H
ATOM 269 H16S OL2 87 35.254 25.304 35.818 1.00 0.00 H
ATOM 270 C117 OL2 87 36.496 25.947 34.189 1.00 0.00 C
ATOM 271 H17R OL2 87 36.285 26.989 34.443 1.00 0.00 H
ATOM 272 H17S OL2 87 35.796 25.668 33.405 1.00 0.00 H
ATOM 273 C118 OL2 87 37.941 25.866 33.666 1.00 0.00 C
ATOM 274 H18R OL2 87 38.030 26.405 32.724 1.00 0.00 H
ATOM 275 H18S OL2 87 38.252 24.835 33.496 1.00 0.00 H
ATOM 276 H18T OL2 87 38.624 26.329 34.378 1.00 0.00 H
ATOM 277 C12 OL 91 27.243 15.678 45.045 1.00 0.00 C
ATOM 278 H2R OL 91 27.223 16.719 45.370 1.00 0.00 H
ATOM 279 H2S OL 91 28.203 15.266 45.365 1.00 0.00 H
ATOM 280 C13 OL 91 27.176 15.636 43.501 1.00 0.00 C
ATOM 281 H3R OL 91 27.229 14.600 43.161 1.00 0.00 H
ATOM 282 H3S OL 91 28.054 16.154 43.112 1.00 0.00 H
ATOM 283 C14 OL 91 25.920 16.314 42.917 1.00 0.00 C
ATOM 284 H4R OL 91 25.045 15.707 43.162 1.00 0.00 H
ATOM 285 H4S OL 91 25.777 17.297 43.372 1.00 0.00 H
ATOM 286 C15 OL 91 26.012 16.472 41.383 1.00 0.00 C
ATOM 287 H5R OL 91 26.438 15.570 40.942 1.00 0.00 H
ATOM 288 H5S OL 91 26.668 17.308 41.130 1.00 0.00 H
ATOM 289 C16 OL 91 24.603 16.695 40.805 1.00 0.00 C
ATOM 290 H6R OL 91 24.152 17.568 41.274 1.00 0.00 H
ATOM 291 H6S OL 91 23.987 15.836 41.083 1.00 0.00 H
ATOM 292 C17 OL 91 24.563 16.831 39.266 1.00 0.00 C
ATOM 293 H7R OL 91 23.725 16.232 38.903 1.00 0.00 H
ATOM 294 H7S OL 91 25.468 16.418 38.822 1.00 0.00 H
ATOM 295 C18 OL 91 24.368 18.284 38.783 1.00 0.00 C
ATOM 296 H8R OL 91 25.349 18.759 38.744 1.00 0.00 H
ATOM 297 H8S OL 91 23.759 18.835 39.494 1.00 0.00 H
ATOM 298 C19 OL 91 23.736 18.310 37.405 1.00 0.00 C
ATOM 299 H9R OL 91 24.120 17.550 36.728 1.00 0.00 H
ATOM 300 C110 OL 91 22.764 19.112 36.970 1.00 0.00 C
ATOM 301 H10R OL 91 22.407 18.981 35.950 1.00 0.00 H
ATOM 302 C111 OL 91 22.094 20.252 37.719 1.00 0.00 C
ATOM 303 H11R OL 91 21.048 19.989 37.891 1.00 0.00 H
ATOM 304 H11S OL 91 22.558 20.426 38.687 1.00 0.00 H
ATOM 305 C112 OL 91 22.135 21.569 36.916 1.00 0.00 C
ATOM 306 H12R OL 91 21.404 22.273 37.319 1.00 0.00 H
ATOM 307 H12S OL 91 21.858 21.367 35.878 1.00 0.00 H
ATOM 308 C113 OL 91 23.539 22.203 36.984 1.00 0.00 C
ATOM 309 H13R OL 91 23.728 22.577 37.992 1.00 0.00 H
ATOM 310 H13S OL 91 24.279 21.426 36.784 1.00 0.00 H
ATOM 311 C114 OL 91 23.722 23.347 35.966 1.00 0.00 C
ATOM 312 H14R OL 91 23.173 23.122 35.048 1.00 0.00 H
ATOM 313 H14S OL 91 23.319 24.278 36.373 1.00 0.00 H
ATOM 314 C115 OL 91 25.216 23.506 35.625 1.00 0.00 C
ATOM 315 H15R OL 91 25.583 22.566 35.217 1.00 0.00 H
ATOM 316 H15S OL 91 25.779 23.696 36.537 1.00 0.00 H
ATOM 317 C116 OL 91 25.459 24.627 34.596 1.00 0.00 C
ATOM 318 H16R OL 91 24.707 24.557 33.808 1.00 0.00 H
ATOM 319 H16S OL 91 25.324 25.592 35.085 1.00 0.00 H
ATOM 320 C117 OL 91 26.855 24.529 33.936 1.00 0.00 C
ATOM 321 H17R OL 91 27.006 23.518 33.552 1.00 0.00 H
ATOM 322 H17S OL 91 26.895 25.202 33.078 1.00 0.00 H
ATOM 323 C118 OL 91 28.011 24.888 34.888 1.00 0.00 C
ATOM 324 H18R OL 91 27.947 24.333 35.821 1.00 0.00 H
ATOM 325 H18S OL 91 28.970 24.659 34.419 1.00 0.00 H
ATOM 326 H18T OL 91 27.994 25.950 35.122 1.00 0.00 H
ATOM 327 C11 PC 92 26.128 14.934 45.756 1.00 0.00 C
ATOM 328 O12 PC 92 24.949 15.213 45.636 1.00 0.00 O
ATOM 329 O11 PC 92 26.582 13.944 46.562 1.00 0.00 O
ATOM 330 C1 PC 92 25.633 13.251 47.429 1.00 0.00 C
ATOM 331 HR PC 92 25.194 13.969 48.132 1.00 0.00 H
ATOM 332 HS PC 92 24.821 12.832 46.825 1.00 0.00 H
ATOM 333 C2 PC 92 26.352 12.122 48.211 1.00 0.00 C
ATOM 334 HX PC 92 25.626 11.613 48.854 1.00 0.00 H
ATOM 335 C3 PC 92 27.508 12.690 49.071 1.00 0.00 C
ATOM 336 HA PC 92 28.375 12.829 48.423 1.00 0.00 H
ATOM 337 HB PC 92 27.228 13.661 49.491 1.00 0.00 H
ATOM 338 O31 PC 92 27.899 11.803 50.158 1.00 0.00 O
ATOM 339 P31 PC 92 27.058 11.692 51.515 1.00 0.00 P
ATOM 340 O32 PC 92 26.029 10.571 51.077 1.00 0.00 O
ATOM 341 C31 PC 92 26.410 9.184 51.094 1.00 0.00 C
ATOM 342 H1A PC 92 27.033 8.980 50.217 1.00 0.00 H
ATOM 343 H1B PC 92 26.979 8.951 52.000 1.00 0.00 H
ATOM 344 C32 PC 92 25.104 8.369 51.037 1.00 0.00 C
ATOM 345 H2A PC 92 24.491 8.754 50.219 1.00 0.00 H
ATOM 346 H2B PC 92 25.338 7.324 50.830 1.00 0.00 H
ATOM 347 N31 PC 92 24.225 8.386 52.276 1.00 0.00 N
ATOM 348 C33 PC 92 22.976 7.618 51.969 1.00 0.00 C
ATOM 349 H3A PC 92 22.314 7.676 52.836 1.00 0.00 H
ATOM 350 H3B PC 92 22.496 8.094 51.110 1.00 0.00 H
ATOM 351 H3C PC 92 23.236 6.584 51.744 1.00 0.00 H
ATOM 352 C34 PC 92 24.914 7.747 53.447 1.00 0.00 C
ATOM 353 H4A PC 92 24.231 7.776 54.298 1.00 0.00 H
ATOM 354 H4B PC 92 25.174 6.720 53.192 1.00 0.00 H
ATOM 355 H4C PC 92 25.809 8.327 53.675 1.00 0.00 H
ATOM 356 C35 PC 92 23.832 9.782 52.669 1.00 0.00 C
ATOM 357 H5A PC 92 23.080 9.738 53.459 1.00 0.00 H
ATOM 358 H5B PC 92 23.423 10.280 51.786 1.00 0.00 H
ATOM 359 H5C PC 92 24.718 10.311 53.024 1.00 0.00 H
ATOM 360 O33 PC 92 27.856 11.247 52.677 1.00 0.00 O
ATOM 361 O34 PC 92 26.343 12.920 51.929 1.00 0.00 O
ATOM 362 O21 PC 92 26.898 11.197 47.225 1.00 0.00 O
ATOM 363 C21 PC 92 26.078 10.301 46.633 1.00 0.00 C
ATOM 364 O22 PC 92 25.008 9.955 47.099 1.00 0.00 O
ATOM 365 C12 OL2 93 26.595 9.836 45.287 1.00 0.00 C
ATOM 366 H2R OL2 93 27.220 8.954 45.439 1.00 0.00 H
ATOM 367 H2S OL2 93 27.230 10.608 44.855 1.00 0.00 H
ATOM 368 C13 OL2 93 25.468 9.508 44.279 1.00 0.00 C
ATOM 369 H3R OL2 93 24.873 8.682 44.676 1.00 0.00 H
ATOM 370 H3S OL2 93 25.912 9.152 43.347 1.00 0.00 H
ATOM 371 C14 OL2 93 24.522 10.700 43.984 1.00 0.00 C
ATOM 372 H4R OL2 93 24.107 11.082 44.919 1.00 0.00 H
ATOM 373 H4S OL2 93 23.675 10.337 43.398 1.00 0.00 H
ATOM 374 C15 OL2 93 25.184 11.869 43.220 1.00 0.00 C
ATOM 375 H5R OL2 93 26.068 12.230 43.750 1.00 0.00 H
ATOM 376 H5S OL2 93 24.470 12.696 43.193 1.00 0.00 H
ATOM 377 C16 OL2 93 25.551 11.485 41.770 1.00 0.00 C
ATOM 378 H6R OL2 93 24.721 10.937 41.317 1.00 0.00 H
ATOM 379 H6S OL2 93 26.426 10.831 41.766 1.00 0.00 H
ATOM 380 C17 OL2 93 25.834 12.743 40.928 1.00 0.00 C
ATOM 381 H7R OL2 93 26.682 13.281 41.353 1.00 0.00 H
ATOM 382 H7S OL2 93 24.966 13.407 40.964 1.00 0.00 H
ATOM 383 C18 OL2 93 26.133 12.387 39.462 1.00 0.00 C
ATOM 384 H8R OL2 93 25.321 11.782 39.062 1.00 0.00 H
ATOM 385 H8S OL2 93 27.039 11.779 39.426 1.00 0.00 H
ATOM 386 C19 OL2 93 26.352 13.651 38.656 1.00 0.00 C
ATOM 387 H9R OL2 93 27.167 14.272 39.017 1.00 0.00 H
ATOM 388 C110 OL2 93 25.661 14.069 37.600 1.00 0.00 C
ATOM 389 H10R OL2 93 25.943 15.014 37.143 1.00 0.00 H
ATOM 390 C111 OL2 93 24.481 13.379 36.943 1.00 0.00 C
ATOM 391 H11R OL2 93 23.591 14.001 37.063 1.00 0.00 H
ATOM 392 H11S OL2 93 24.271 12.422 37.415 1.00 0.00 H
ATOM 393 C112 OL2 93 24.713 13.139 35.439 1.00 0.00 C
ATOM 394 H12R OL2 93 23.852 12.609 35.026 1.00 0.00 H
ATOM 395 H12S OL2 93 25.588 12.498 35.306 1.00 0.00 H
ATOM 396 C113 OL2 93 24.918 14.456 34.665 1.00 0.00 C
ATOM 397 H13R OL2 93 25.789 14.977 35.065 1.00 0.00 H
ATOM 398 H13S OL2 93 24.051 15.107 34.804 1.00 0.00 H
ATOM 399 C114 OL2 93 25.122 14.181 33.162 1.00 0.00 C
ATOM 400 H14R OL2 93 24.203 13.756 32.752 1.00 0.00 H
ATOM 401 H14S OL2 93 25.918 13.446 33.017 1.00 0.00 H
ATOM 402 C115 OL2 93 25.467 15.466 32.387 1.00 0.00 C
ATOM 403 H15R OL2 93 24.760 16.249 32.663 1.00 0.00 H
ATOM 404 H15S OL2 93 25.350 15.278 31.318 1.00 0.00 H
ATOM 405 C116 OL2 93 26.904 15.951 32.671 1.00 0.00 C
ATOM 406 H16R OL2 93 27.630 15.187 32.384 1.00 0.00 H
ATOM 407 H16S OL2 93 27.025 16.133 33.740 1.00 0.00 H
ATOM 408 C117 OL2 93 27.203 17.264 31.934 1.00 0.00 C
ATOM 409 H17R OL2 93 28.062 17.732 32.412 1.00 0.00 H
ATOM 410 H17S OL2 93 26.358 17.942 32.032 1.00 0.00 H
ATOM 411 C118 OL2 93 27.493 17.060 30.442 1.00 0.00 C
ATOM 412 H18R OL2 93 28.380 16.440 30.300 1.00 0.00 H
ATOM 413 H18S OL2 93 27.667 18.028 29.967 1.00 0.00 H
ATOM 414 H18T OL2 93 26.644 16.582 29.951 1.00 0.00 H
ATOM 415 C12 OL 94 41.252 12.587 49.162 1.00 0.00 C
ATOM 416 H2R OL 94 41.657 13.166 49.990 1.00 0.00 H
ATOM 417 H2S OL 94 41.660 13.005 48.241 1.00 0.00 H
ATOM 418 C13 OL 94 41.659 11.101 49.299 1.00 0.00 C
ATOM 419 H3R OL 94 41.440 10.568 48.371 1.00 0.00 H
ATOM 420 H3S OL 94 41.062 10.636 50.087 1.00 0.00 H
ATOM 421 C14 OL 94 43.145 10.926 49.679 1.00 0.00 C
ATOM 422 H4R OL 94 43.316 9.885 49.957 1.00 0.00 H
ATOM 423 H4S OL 94 43.349 11.515 50.573 1.00 0.00 H
ATOM 424 C15 OL 94 44.124 11.348 48.556 1.00 0.00 C
ATOM 425 H5R OL 94 45.018 11.788 49.004 1.00 0.00 H
ATOM 426 H5S OL 94 43.670 12.120 47.938 1.00 0.00 H
ATOM 427 C16 OL 94 44.541 10.162 47.661 1.00 0.00 C
ATOM 428 H6R OL 94 44.976 10.540 46.736 1.00 0.00 H
ATOM 429 H6S OL 94 43.660 9.574 47.392 1.00 0.00 H
ATOM 430 C17 OL 94 45.582 9.280 48.376 1.00 0.00 C
ATOM 431 H7R OL 94 45.199 8.989 49.355 1.00 0.00 H
ATOM 432 H7S OL 94 46.490 9.861 48.540 1.00 0.00 H
ATOM 433 C18 OL 94 45.920 7.998 47.595 1.00 0.00 C
ATOM 434 H8R OL 94 45.012 7.574 47.166 1.00 0.00 H
ATOM 435 H8S OL 94 46.301 7.262 48.306 1.00 0.00 H
ATOM 436 C19 OL 94 46.990 8.229 46.547 1.00 0.00 C
ATOM 437 H9R OL 94 48.006 8.262 46.933 1.00 0.00 H
ATOM 438 C110 OL 94 46.795 8.358 45.241 1.00 0.00 C
ATOM 439 H10R OL 94 47.660 8.492 44.596 1.00 0.00 H
ATOM 440 C111 OL 94 45.452 8.407 44.540 1.00 0.00 C
ATOM 441 H11R OL 94 45.080 9.434 44.578 1.00 0.00 H
ATOM 442 H11S OL 94 44.713 7.774 45.034 1.00 0.00 H
ATOM 443 C112 OL 94 45.577 7.991 43.060 1.00 0.00 C
ATOM 444 H12R OL 94 45.671 6.905 43.001 1.00 0.00 H
ATOM 445 H12S OL 94 46.478 8.425 42.621 1.00 0.00 H
ATOM 446 C113 OL 94 44.352 8.467 42.254 1.00 0.00 C
ATOM 447 H13R OL 94 43.440 8.185 42.784 1.00 0.00 H
ATOM 448 H13S OL 94 44.370 9.557 42.185 1.00 0.00 H
ATOM 449 C114 OL 94 44.330 7.845 40.841 1.00 0.00 C
ATOM 450 H14R OL 94 45.223 8.136 40.281 1.00 0.00 H
ATOM 451 H14S OL 94 44.345 6.757 40.940 1.00 0.00 H
ATOM 452 C115 OL 94 43.060 8.249 40.065 1.00 0.00 C
ATOM 453 H15R OL 94 42.198 8.147 40.727 1.00 0.00 H
ATOM 454 H15S OL 94 42.908 7.556 39.234 1.00 0.00 H
ATOM 455 C116 OL 94 43.154 9.686 39.502 1.00 0.00 C
ATOM 456 H16R OL 94 43.854 9.688 38.664 1.00 0.00 H
ATOM 457 H16S OL 94 43.552 10.367 40.256 1.00 0.00 H
ATOM 458 C117 OL 94 41.791 10.223 39.020 1.00 0.00 C
ATOM 459 H17R OL 94 41.956 11.167 38.495 1.00 0.00 H
ATOM 460 H17S OL 94 41.346 9.527 38.305 1.00 0.00 H
ATOM 461 C118 OL 94 40.818 10.468 40.191 1.00 0.00 C
ATOM 462 H18R OL 94 39.947 11.035 39.856 1.00 0.00 H
ATOM 463 H18S OL 94 40.464 9.524 40.608 1.00 0.00 H
ATOM 464 H18T OL 94 41.306 11.037 40.985 1.00 0.00 H
ATOM 465 C11 PC 95 39.754 12.760 49.170 1.00 0.00 C
ATOM 466 O12 PC 95 39.007 12.140 49.909 1.00 0.00 O
ATOM 467 O11 PC 95 39.319 13.629 48.234 1.00 0.00 O
ATOM 468 C1 PC 95 37.889 13.809 48.022 1.00 0.00 C
ATOM 469 HR PC 95 37.749 13.974 46.950 1.00 0.00 H
ATOM 470 HS PC 95 37.332 12.905 48.288 1.00 0.00 H
ATOM 471 C2 PC 95 37.351 15.038 48.799 1.00 0.00 C
ATOM 472 HX PC 95 37.817 15.941 48.389 1.00 0.00 H
ATOM 473 C3 PC 95 37.602 14.999 50.326 1.00 0.00 C
ATOM 474 HA PC 95 37.122 14.125 50.778 1.00 0.00 H
ATOM 475 HB PC 95 38.679 14.947 50.517 1.00 0.00 H
ATOM 476 O31 PC 95 37.050 16.222 50.902 1.00 0.00 O
ATOM 477 P31 PC 95 37.805 17.005 52.072 1.00 0.00 P
ATOM 478 O32 PC 95 39.184 17.282 51.342 1.00 0.00 O
ATOM 479 C31 PC 95 39.340 18.377 50.422 1.00 0.00 C
ATOM 480 H1A PC 95 39.281 17.983 49.405 1.00 0.00 H
ATOM 481 H1B PC 95 38.552 19.122 50.568 1.00 0.00 H
ATOM 482 C32 PC 95 40.719 19.020 50.652 1.00 0.00 C
ATOM 483 H2A PC 95 41.481 18.389 50.209 1.00 0.00 H
ATOM 484 H2B PC 95 40.755 19.982 50.135 1.00 0.00 H
ATOM 485 N31 PC 95 41.149 19.276 52.081 1.00 0.00 N
ATOM 486 C33 PC 95 41.510 18.023 52.826 1.00 0.00 C
ATOM 487 H3A PC 95 41.894 18.302 53.803 1.00 0.00 H
ATOM 488 H3B PC 95 40.619 17.408 52.953 1.00 0.00 H
ATOM 489 H3C PC 95 42.260 17.475 52.258 1.00 0.00 H
ATOM 490 C34 PC 95 42.372 20.128 52.068 1.00 0.00 C
ATOM 491 H4A PC 95 43.155 19.602 51.522 1.00 0.00 H
ATOM 492 H4B PC 95 42.130 21.069 51.578 1.00 0.00 H
ATOM 493 H4C PC 95 42.663 20.311 53.102 1.00 0.00 H
ATOM 494 C35 PC 95 40.064 19.991 52.820 1.00 0.00 C
ATOM 495 H5A PC 95 39.759 20.851 52.225 1.00 0.00 H
ATOM 496 H5B PC 95 40.444 20.306 53.793 1.00 0.00 H
ATOM 497 H5C PC 95 39.227 19.304 52.945 1.00 0.00 H
ATOM 498 O33 PC 95 37.985 16.235 53.325 1.00 0.00 O
ATOM 499 O34 PC 95 37.123 18.270 52.449 1.00 0.00 O
ATOM 500 O21 PC 95 35.913 15.121 48.629 1.00 0.00 O
ATOM 501 C21 PC 95 35.385 15.457 47.433 1.00 0.00 C
ATOM 502 O22 PC 95 36.014 15.553 46.397 1.00 0.00 O
ATOM 503 C12 OL2 96 33.907 15.700 47.556 1.00 0.00 C
ATOM 504 H2R OL2 96 33.777 16.713 47.944 1.00 0.00 H
ATOM 505 H2S OL2 96 33.482 15.030 48.296 1.00 0.00 H
ATOM 506 C13 OL2 96 33.150 15.576 46.225 1.00 0.00 C
ATOM 507 H3R OL2 96 33.681 16.159 45.478 1.00 0.00 H
ATOM 508 H3S OL2 96 32.178 16.041 46.346 1.00 0.00 H
ATOM 509 C14 OL2 96 32.921 14.141 45.704 1.00 0.00 C
ATOM 510 H4R OL2 96 32.969 13.417 46.519 1.00 0.00 H
ATOM 511 H4S OL2 96 33.724 13.900 45.005 1.00 0.00 H
ATOM 512 C15 OL2 96 31.539 14.032 45.004 1.00 0.00 C
ATOM 513 H5R OL2 96 31.231 14.998 44.623 1.00 0.00 H
ATOM 514 H5S OL2 96 30.786 13.754 45.740 1.00 0.00 H
ATOM 515 C16 OL2 96 31.543 13.037 43.827 1.00 0.00 C
ATOM 516 H6R OL2 96 31.498 12.035 44.244 1.00 0.00 H
ATOM 517 H6S OL2 96 32.481 13.109 43.275 1.00 0.00 H
ATOM 518 C17 OL2 96 30.365 13.218 42.835 1.00 0.00 C
ATOM 519 H7R OL2 96 29.415 13.111 43.362 1.00 0.00 H
ATOM 520 H7S OL2 96 30.417 12.411 42.107 1.00 0.00 H
ATOM 521 C18 OL2 96 30.385 14.559 42.065 1.00 0.00 C
ATOM 522 H8R OL2 96 31.391 14.752 41.695 1.00 0.00 H
ATOM 523 H8S OL2 96 30.112 15.363 42.749 1.00 0.00 H
ATOM 524 C19 OL2 96 29.429 14.544 40.887 1.00 0.00 C
ATOM 525 H9R OL2 96 28.719 13.720 40.876 1.00 0.00 H
ATOM 526 C110 OL2 96 29.455 15.394 39.863 1.00 0.00 C
ATOM 527 H10R OL2 96 28.753 15.267 39.043 1.00 0.00 H
ATOM 528 C111 OL2 96 30.352 16.610 39.744 1.00 0.00 C
ATOM 529 H11R OL2 96 30.789 16.850 40.712 1.00 0.00 H
ATOM 530 H11S OL2 96 29.758 17.477 39.446 1.00 0.00 H
ATOM 531 C112 OL2 96 31.493 16.402 38.730 1.00 0.00 C
ATOM 532 H12R OL2 96 31.981 15.445 38.929 1.00 0.00 H
ATOM 533 H12S OL2 96 32.233 17.190 38.880 1.00 0.00 H
ATOM 534 C113 OL2 96 31.009 16.432 37.265 1.00 0.00 C
ATOM 535 H13R OL2 96 30.589 17.413 37.033 1.00 0.00 H
ATOM 536 H13S OL2 96 30.209 15.700 37.134 1.00 0.00 H
ATOM 537 C114 OL2 96 32.149 16.092 36.277 1.00 0.00 C
ATOM 538 H14R OL2 96 31.732 16.025 35.270 1.00 0.00 H
ATOM 539 H14S OL2 96 32.544 15.102 36.520 1.00 0.00 H
ATOM 540 C115 OL2 96 33.319 17.106 36.269 1.00 0.00 C
ATOM 541 H15R OL2 96 34.086 16.724 35.592 1.00 0.00 H
ATOM 542 H15S OL2 96 33.778 17.178 37.257 1.00 0.00 H
ATOM 543 C116 OL2 96 32.882 18.506 35.787 1.00 0.00 C
ATOM 544 H16R OL2 96 32.283 19.004 36.553 1.00 0.00 H
ATOM 545 H16S OL2 96 32.254 18.392 34.904 1.00 0.00 H
ATOM 546 C117 OL2 96 34.099 19.381 35.423 1.00 0.00 C
ATOM 547 H17R OL2 96 34.783 18.816 34.786 1.00 0.00 H
ATOM 548 H17S OL2 96 34.641 19.656 36.331 1.00 0.00 H
ATOM 549 C118 OL2 96 33.662 20.648 34.668 1.00 0.00 C
ATOM 550 H18R OL2 96 34.534 21.238 34.384 1.00 0.00 H
ATOM 551 H18S OL2 96 33.128 20.383 33.754 1.00 0.00 H
ATOM 552 H18T OL2 96 33.010 21.265 35.290 1.00 0.00 H
ATOM 553 C12 OL 112 35.230 17.578 17.575 1.00 0.00 C
ATOM 554 H2R OL 112 35.255 17.561 16.484 1.00 0.00 H
ATOM 555 H2S OL 112 34.224 17.880 17.876 1.00 0.00 H
ATOM 556 C13 OL 112 36.252 18.604 18.103 1.00 0.00 C
ATOM 557 H3R OL 112 36.028 19.588 17.691 1.00 0.00 H
ATOM 558 H3S OL 112 37.251 18.339 17.762 1.00 0.00 H
ATOM 559 C14 OL 112 36.235 18.690 19.638 1.00 0.00 C
ATOM 560 H4R OL 112 36.711 17.800 20.056 1.00 0.00 H
ATOM 561 H4S OL 112 35.202 18.717 19.992 1.00 0.00 H
ATOM 562 C15 OL 112 36.968 19.957 20.119 1.00 0.00 C
ATOM 563 H5R OL 112 36.357 20.840 19.915 1.00 0.00 H
ATOM 564 H5S OL 112 37.899 20.070 19.561 1.00 0.00 H
ATOM 565 C16 OL 112 37.309 19.887 21.618 1.00 0.00 C
ATOM 566 H6R OL 112 37.850 20.793 21.894 1.00 0.00 H
ATOM 567 H6S OL 112 37.976 19.040 21.780 1.00 0.00 H
ATOM 568 C17 OL 112 36.063 19.756 22.521 1.00 0.00 C
ATOM 569 H7R OL 112 35.492 18.864 22.259 1.00 0.00 H
ATOM 570 H7S OL 112 35.415 20.621 22.365 1.00 0.00 H
ATOM 571 C18 OL 112 36.450 19.677 24.009 1.00 0.00 C
ATOM 572 H8R OL 112 37.065 20.546 24.251 1.00 0.00 H
ATOM 573 H8S OL 112 35.539 19.757 24.600 1.00 0.00 H
ATOM 574 C19 OL 112 37.222 18.405 24.324 1.00 0.00 C
ATOM 575 H9R OL 112 38.030 18.179 23.632 1.00 0.00 H
ATOM 576 C110 OL 112 37.016 17.567 25.335 1.00 0.00 C
ATOM 577 H10R OL 112 37.657 16.694 25.428 1.00 0.00 H
ATOM 578 C111 OL 112 35.958 17.696 26.409 1.00 0.00 C
ATOM 579 H11R OL 112 35.289 18.517 26.190 1.00 0.00 H
ATOM 580 H11S OL 112 36.439 17.916 27.362 1.00 0.00 H
ATOM 581 C112 OL 112 35.120 16.409 26.530 1.00 0.00 C
ATOM 582 H12R OL 112 34.773 16.128 25.534 1.00 0.00 H
ATOM 583 H12S OL 112 35.742 15.592 26.903 1.00 0.00 H
ATOM 584 C113 OL 112 33.886 16.596 27.442 1.00 0.00 C
ATOM 585 H13R OL 112 33.305 17.457 27.105 1.00 0.00 H
ATOM 586 H13S OL 112 33.241 15.721 27.350 1.00 0.00 H
ATOM 587 C114 OL 112 34.275 16.773 28.921 1.00 0.00 C
ATOM 588 H14R OL 112 34.845 15.904 29.249 1.00 0.00 H
ATOM 589 H14S OL 112 34.919 17.645 29.039 1.00 0.00 H
ATOM 590 C115 OL 112 33.039 16.915 29.829 1.00 0.00 C
ATOM 591 H15R OL 112 32.479 15.979 29.786 1.00 0.00 H
ATOM 592 H15S OL 112 32.383 17.716 29.480 1.00 0.00 H
ATOM 593 C116 OL 112 33.505 17.206 31.270 1.00 0.00 C
ATOM 594 H16R OL 112 34.316 16.524 31.509 1.00 0.00 H
ATOM 595 H16S OL 112 33.948 18.202 31.311 1.00 0.00 H
ATOM 596 C117 OL 112 32.413 17.108 32.362 1.00 0.00 C
ATOM 597 H17R OL 112 32.906 16.896 33.311 1.00 0.00 H
ATOM 598 H17S OL 112 31.941 18.081 32.475 1.00 0.00 H
ATOM 599 C118 OL 112 31.319 16.044 32.127 1.00 0.00 C
ATOM 600 H18R OL 112 30.708 16.302 31.260 1.00 0.00 H
ATOM 601 H18S OL 112 31.749 15.056 31.962 1.00 0.00 H
ATOM 602 H18T OL 112 30.661 15.986 32.996 1.00 0.00 H
ATOM 603 C11 PC 113 35.502 16.178 18.066 1.00 0.00 C
ATOM 604 O12 PC 113 36.590 15.637 17.992 1.00 0.00 O
ATOM 605 O11 PC 113 34.395 15.586 18.568 1.00 0.00 O
ATOM 606 C1 PC 113 34.377 14.143 18.752 1.00 0.00 C
ATOM 607 HR PC 113 35.282 13.818 19.276 1.00 0.00 H
ATOM 608 HS PC 113 33.500 13.880 19.351 1.00 0.00 H
ATOM 609 C2 PC 113 34.274 13.454 17.372 1.00 0.00 C
ATOM 610 HX PC 113 35.212 13.581 16.822 1.00 0.00 H
ATOM 611 C3 PC 113 33.131 14.021 16.511 1.00 0.00 C
ATOM 612 HA PC 113 32.554 13.197 16.078 1.00 0.00 H
ATOM 613 HB PC 113 32.454 14.653 17.094 1.00 0.00 H
ATOM 614 O31 PC 113 33.735 14.793 15.447 1.00 0.00 O
ATOM 615 P31 PC 113 32.915 15.050 14.111 1.00 0.00 P
ATOM 616 O32 PC 113 31.650 15.845 14.694 1.00 0.00 O
ATOM 617 C31 PC 113 31.768 17.171 15.276 1.00 0.00 C
ATOM 618 H1A PC 113 30.813 17.449 15.736 1.00 0.00 H
ATOM 619 H1B PC 113 32.528 17.149 16.065 1.00 0.00 H
ATOM 620 C32 PC 113 32.163 18.216 14.208 1.00 0.00 C
ATOM 621 H2A PC 113 32.325 19.181 14.694 1.00 0.00 H
ATOM 622 H2B PC 113 33.101 17.921 13.743 1.00 0.00 H
ATOM 623 N31 PC 113 31.200 18.484 13.073 1.00 0.00 N
ATOM 624 C33 PC 113 30.845 17.249 12.295 1.00 0.00 C
ATOM 625 H3A PC 113 31.768 16.776 11.957 1.00 0.00 H
ATOM 626 H3B PC 113 30.289 16.574 12.945 1.00 0.00 H
ATOM 627 H3C PC 113 30.239 17.536 11.437 1.00 0.00 H
ATOM 628 C34 PC 113 29.952 19.117 13.597 1.00 0.00 C
ATOM 629 H4A PC 113 30.226 20.057 14.077 1.00 0.00 H
ATOM 630 H4B PC 113 29.272 19.298 12.763 1.00 0.00 H
ATOM 631 H4C PC 113 29.496 18.447 14.325 1.00 0.00 H
ATOM 632 C35 PC 113 31.857 19.447 12.141 1.00 0.00 C
ATOM 633 H5A PC 113 32.751 18.979 11.728 1.00 0.00 H
ATOM 634 H5B PC 113 32.119 20.343 12.704 1.00 0.00 H
ATOM 635 H5C PC 113 31.155 19.693 11.342 1.00 0.00 H
ATOM 636 O33 PC 113 33.696 15.807 13.107 1.00 0.00 O
ATOM 637 O34 PC 113 32.531 13.784 13.445 1.00 0.00 O
ATOM 638 O21 PC 113 34.004 12.042 17.537 1.00 0.00 O
ATOM 639 C21 PC 113 35.026 11.166 17.617 1.00 0.00 C
ATOM 640 O22 PC 113 36.204 11.474 17.625 1.00 0.00 O
ATOM 641 C12 OL2 114 34.555 9.740 17.753 1.00 0.00 C
ATOM 642 H2R OL2 114 35.424 9.079 17.770 1.00 0.00 H
ATOM 643 H2S OL2 114 33.952 9.480 16.881 1.00 0.00 H
ATOM 644 C13 OL2 114 33.722 9.540 19.035 1.00 0.00 C
ATOM 645 H3R OL2 114 33.474 8.482 19.142 1.00 0.00 H
ATOM 646 H3S OL2 114 32.782 10.092 18.952 1.00 0.00 H
ATOM 647 C14 OL2 114 34.496 10.024 20.276 1.00 0.00 C
ATOM 648 H4R OL2 114 34.701 11.094 20.192 1.00 0.00 H
ATOM 649 H4S OL2 114 35.456 9.507 20.337 1.00 0.00 H
ATOM 650 C15 OL2 114 33.701 9.781 21.566 1.00 0.00 C
ATOM 651 H5R OL2 114 33.558 8.709 21.720 1.00 0.00 H
ATOM 652 H5S OL2 114 32.716 10.250 21.489 1.00 0.00 H
ATOM 653 C16 OL2 114 34.468 10.390 22.748 1.00 0.00 C
ATOM 654 H6R OL2 114 34.580 11.463 22.580 1.00 0.00 H
ATOM 655 H6S OL2 114 35.470 9.957 22.799 1.00 0.00 H
ATOM 656 C17 OL2 114 33.736 10.137 24.075 1.00 0.00 C
ATOM 657 H7R OL2 114 33.691 9.063 24.268 1.00 0.00 H
ATOM 658 H7S OL2 114 32.709 10.507 24.015 1.00 0.00 H
ATOM 659 C18 OL2 114 34.462 10.834 25.235 1.00 0.00 C
ATOM 660 H8R OL2 114 35.512 10.534 25.234 1.00 0.00 H
ATOM 661 H8S OL2 114 34.036 10.476 26.171 1.00 0.00 H
ATOM 662 C19 OL2 114 34.365 12.344 25.110 1.00 0.00 C
ATOM 663 H9R OL2 114 34.881 12.774 24.254 1.00 0.00 H
ATOM 664 C110 OL2 114 33.739 13.155 25.956 1.00 0.00 C
ATOM 665 H10R OL2 114 33.744 14.225 25.768 1.00 0.00 H
ATOM 666 C111 OL2 114 32.990 12.719 27.197 1.00 0.00 C
ATOM 667 H11R OL2 114 32.617 11.699 27.097 1.00 0.00 H
ATOM 668 H11S OL2 114 32.110 13.354 27.326 1.00 0.00 H
ATOM 669 C112 OL2 114 33.863 12.826 28.461 1.00 0.00 C
ATOM 670 H12R OL2 114 33.327 12.375 29.300 1.00 0.00 H
ATOM 671 H12S OL2 114 34.007 13.879 28.703 1.00 0.00 H
ATOM 672 C113 OL2 114 35.248 12.156 28.308 1.00 0.00 C
ATOM 673 H13R OL2 114 35.828 12.678 27.545 1.00 0.00 H
ATOM 674 H13S OL2 114 35.146 11.111 28.011 1.00 0.00 H
ATOM 675 C114 OL2 114 35.985 12.233 29.647 1.00 0.00 C
ATOM 676 H14R OL2 114 35.776 13.212 30.085 1.00 0.00 H
ATOM 677 H14S OL2 114 35.580 11.471 30.314 1.00 0.00 H
ATOM 678 C115 OL2 114 37.515 12.056 29.541 1.00 0.00 C
ATOM 679 H15R OL2 114 37.873 12.427 28.578 1.00 0.00 H
ATOM 680 H15S OL2 114 37.769 10.995 29.601 1.00 0.00 H
ATOM 681 C116 OL2 114 38.233 12.841 30.662 1.00 0.00 C
ATOM 682 H16R OL2 114 38.114 13.903 30.476 1.00 0.00 H
ATOM 683 H16S OL2 114 39.304 12.636 30.634 1.00 0.00 H
ATOM 684 C117 OL2 114 37.664 12.528 32.058 1.00 0.00 C
ATOM 685 H17R OL2 114 37.934 11.514 32.326 1.00 0.00 H
ATOM 686 H17S OL2 114 36.586 12.544 32.044 1.00 0.00 H
ATOM 687 C118 OL2 114 38.102 13.554 33.118 1.00 0.00 C
ATOM 688 H18R OL2 114 37.829 14.564 32.805 1.00 0.00 H
ATOM 689 H18S OL2 114 39.176 13.522 33.286 1.00 0.00 H
ATOM 690 H18T OL2 114 37.599 13.350 34.063 1.00 0.00 H
END
|