1 |
gezelter |
1490 |
128 |
2 |
|
|
0; 20 0 0; 0 20 0; 0 0 20; |
3 |
|
|
CH3 -4.605786 -1.153377 0.626235 0.000960 -0.000109 -0.003493 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
4 |
|
|
CH2 -3.181701 -1.194119 1.210976 -0.001906 0.000750 0.003547 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
5 |
|
|
CH2 -2.631995 -2.560619 1.660530 -0.001214 0.000067 0.000623 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
6 |
|
|
CH3 -1.199907 -2.340753 2.182435 -0.001613 0.001222 0.001232 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
7 |
|
|
CH3 27.407023 11.833875 10.385983 -0.003589 -0.000763 -0.001439 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
8 |
|
|
CH2 28.221081 10.811217 9.571686 0.001305 0.001383 0.000759 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
9 |
|
|
CH2 28.152500 11.194403 8.081698 0.005699 0.003168 0.001016 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
10 |
|
|
CH3 28.692358 12.585157 7.699654 0.001915 0.004575 0.000790 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
11 |
|
|
CH3 3.712472 2.861613 -2.072605 -0.002823 -0.000534 -0.000572 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
12 |
|
|
CH2 3.993282 4.146751 -2.873333 -0.004187 -0.000564 -0.001099 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
13 |
|
|
CH2 4.097117 3.903458 -4.390444 0.002554 0.003483 -0.001287 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
14 |
|
|
CH3 5.199353 2.912021 -4.807250 -0.001284 -0.000334 -0.002357 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
15 |
|
|
CH3 6.736632 18.433243 -2.265795 -0.003182 0.000721 0.001560 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
16 |
|
|
CH2 5.702306 18.790261 -1.182140 -0.002593 0.000153 0.002310 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
17 |
|
|
CH2 5.200572 17.525013 -0.461716 -0.005820 0.001334 0.002136 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
18 |
|
|
CH3 3.986220 17.887591 0.413206 -0.007432 0.004810 -0.001542 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
19 |
|
|
CH3 9.130333 25.885001 13.197060 0.000819 0.001419 0.000363 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
20 |
|
|
CH2 10.345611 25.505938 14.063669 0.005474 0.001458 -0.006147 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
21 |
|
|
CH2 11.585733 26.317249 13.644776 0.001924 0.007787 -0.004399 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
22 |
|
|
CH3 12.828433 25.918732 14.462382 -0.006360 -0.000051 0.004372 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
23 |
|
|
CH3 11.365479 -1.287189 18.927876 0.003176 -0.006111 -0.000178 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
24 |
|
|
CH2 11.675249 -1.937784 17.566859 0.000330 -0.001055 -0.003242 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
25 |
|
|
CH2 10.474352 -1.917332 16.602998 -0.000880 -0.004497 -0.001808 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
26 |
|
|
CH3 10.814210 -2.394325 15.178718 0.002143 0.001579 -0.003121 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
27 |
|
|
CH3 -2.048788 -0.289256 29.340060 0.001131 0.000276 -0.004522 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
28 |
|
|
CH2 -2.068056 0.766317 30.461217 -0.001874 -0.000407 -0.003930 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
29 |
|
|
CH2 -2.114285 2.219945 29.954830 0.004116 -0.000292 -0.004145 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
30 |
|
|
CH3 -3.529562 2.752114 29.662617 0.003526 0.002114 0.003091 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
31 |
|
|
CH3 10.022124 21.191281 41.944660 0.007988 0.005322 -0.006051 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
32 |
|
|
CH2 9.135784 21.682493 43.104277 0.003135 -0.004569 -0.005571 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
33 |
|
|
CH2 9.071494 20.677027 44.268968 0.000616 -0.000232 -0.001965 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
34 |
|
|
CH3 8.492551 19.295304 43.912224 0.002189 -0.001847 0.001738 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
35 |
|
|
CH3 20.156196 23.564588 0.315189 -0.000225 -0.002154 0.008934 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
36 |
|
|
CH2 19.535099 22.171444 0.103084 0.006737 -0.004136 0.001567 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
37 |
|
|
CH2 19.461150 21.647173 -1.343039 0.002778 -0.004129 0.001767 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
38 |
|
|
CH3 18.911269 20.214976 -1.477367 -0.002440 -0.001788 -0.001835 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
39 |
|
|
CH3 2.811525 -3.212675 -3.926644 -0.001987 -0.004701 0.004023 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
40 |
|
|
CH2 1.697410 -2.208551 -3.577240 -0.000663 -0.001689 -0.000412 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
41 |
|
|
CH2 0.727420 -2.623649 -2.455449 0.000614 0.003652 0.002668 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
42 |
|
|
CH3 0.341601 -4.110521 -2.346093 0.001156 0.002856 -0.006253 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
43 |
|
|
CH3 16.494970 5.043967 17.489577 0.006404 0.001294 0.005403 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
44 |
|
|
CH2 16.024343 3.717492 18.114538 0.005411 0.000467 0.002899 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
45 |
|
|
CH2 15.782245 3.900286 19.624364 0.001330 -0.002042 0.002549 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
46 |
|
|
CH3 15.143116 2.702956 20.352042 -0.000971 -0.000320 0.003361 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
47 |
|
|
CH3 -17.295298 2.686332 10.530910 -0.004586 -0.001660 -0.002529 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
48 |
|
|
CH2 -17.113019 3.028295 9.040462 -0.000228 0.001513 -0.001268 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
49 |
|
|
CH2 -15.941854 4.016862 8.889773 0.002826 -0.002363 -0.002959 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
50 |
|
|
CH3 -15.515205 4.334781 7.444610 -0.001784 0.001366 -0.003500 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
51 |
|
|
CH3 -24.280566 6.811101 8.303048 -0.001209 0.002966 -0.001885 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
52 |
|
|
CH2 -25.820565 6.809612 8.302200 -0.001212 0.002070 0.004604 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
53 |
|
|
CH2 -26.446668 7.033619 9.691234 -0.002373 0.007123 0.003266 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
54 |
|
|
CH3 -26.096142 6.108698 10.871595 0.001604 0.000726 -0.002928 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
55 |
|
|
CH3 12.409212 1.943746 13.913354 0.004315 0.004828 -0.004647 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
56 |
|
|
CH2 12.199701 1.580109 12.431641 -0.005131 -0.002365 -0.001546 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
57 |
|
|
CH2 12.439513 2.819991 11.550289 0.001604 0.000277 0.004003 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
58 |
|
|
CH3 11.933652 2.594561 10.113318 0.000242 -0.004462 0.005225 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
59 |
|
|
CH3 -5.954249 0.289204 4.573394 0.001271 -0.000264 0.003732 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
60 |
|
|
CH2 -7.337015 0.250779 5.250212 -0.000922 -0.000976 -0.000788 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
61 |
|
|
CH2 -7.319935 -0.134109 6.741241 0.004916 0.004935 0.000671 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
62 |
|
|
CH3 -8.698120 -0.314115 7.404418 0.003733 -0.001958 -0.003658 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
63 |
|
|
CH3 -0.434315 11.693497 12.276109 -0.008457 -0.004560 0.001811 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
64 |
|
|
CH2 -0.909188 13.096772 12.696721 0.004716 -0.000044 0.001616 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
65 |
|
|
CH2 -2.200500 13.520582 11.972498 0.008772 0.005692 -0.002259 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
66 |
|
|
CH3 -2.874440 14.864342 12.306735 0.005925 0.003696 0.000023 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
67 |
|
|
CH3 1.339057 -20.460245 -27.197367 0.002616 -0.001936 0.003881 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
68 |
|
|
CH2 2.086458 -21.452838 -28.107176 0.000431 0.001873 -0.002069 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
69 |
|
|
CH2 1.078402 -22.526433 -28.557527 0.000291 0.000562 0.001369 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
70 |
|
|
CH3 1.711571 -23.603529 -29.457839 0.000296 0.000289 0.001700 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
71 |
|
|
CH3 3.014800 12.950353 12.704075 -0.001557 -0.005955 0.001000 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
72 |
|
|
CH2 3.746004 11.713470 12.149945 0.002242 -0.001620 -0.003662 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
73 |
|
|
CH2 3.286028 10.402313 12.813940 -0.000509 0.000074 -0.002222 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
74 |
|
|
CH3 3.882415 9.107503 12.231370 -0.000037 -0.001266 0.001241 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
75 |
|
|
CH3 3.945718 -41.636672 4.684608 0.000155 -0.004631 -0.006043 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
76 |
|
|
CH2 2.597884 -41.756515 5.419852 0.002507 0.002202 -0.000618 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
77 |
|
|
CH2 2.133492 -40.392807 5.964133 0.000318 -0.001220 0.006089 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
78 |
|
|
CH3 0.829471 -40.279581 6.775496 -0.002671 -0.002881 0.001517 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
79 |
|
|
CH3 15.339534 -13.530099 3.943045 -0.003382 0.003903 -0.002454 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
80 |
|
|
CH2 14.099040 -14.157215 3.280096 -0.001111 -0.002464 -0.000680 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
81 |
|
|
CH2 13.656056 -15.510344 3.866959 -0.001791 -0.001002 0.002178 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
82 |
|
|
CH3 12.364478 -16.075815 3.247550 0.001274 -0.000034 -0.005098 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
83 |
|
|
CH3 10.703436 28.055215 27.395713 0.005589 0.000223 -0.000205 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
84 |
|
|
CH2 10.574453 26.619680 26.853307 -0.001648 -0.000185 0.002596 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
85 |
|
|
CH2 9.202161 26.371827 26.199867 -0.002069 0.002148 0.002594 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
86 |
|
|
CH3 9.017873 24.856471 25.996560 -0.005190 0.002374 0.003740 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
87 |
|
|
CH3 31.609188 13.682808 -6.316798 -0.005718 -0.002352 0.004258 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
88 |
|
|
CH2 32.823784 13.014840 -5.645848 -0.002397 -0.001166 -0.000573 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
89 |
|
|
CH2 33.897557 12.392134 -6.557358 -0.002578 -0.002594 0.000190 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
90 |
|
|
CH3 33.240044 11.782255 -7.809286 -0.003469 0.005713 -0.003388 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
91 |
|
|
CH3 0.009928 3.438051 13.739779 0.002667 -0.004625 0.003086 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
92 |
|
|
CH2 -1.407138 3.992902 13.503850 0.003304 -0.001890 0.005696 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
93 |
|
|
CH2 -2.417580 3.326526 14.455980 -0.001216 0.002007 0.003626 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
94 |
|
|
CH3 -2.740005 1.876871 14.048378 0.002746 0.003802 -0.005894 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
95 |
|
|
CH3 15.816754 32.498504 -0.952291 0.001097 -0.002360 0.002205 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
96 |
|
|
CH2 14.804895 32.269135 0.185747 -0.000979 -0.000213 0.000792 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
97 |
|
|
CH2 13.937024 33.442808 0.676553 -0.002254 -0.000954 0.000309 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
98 |
|
|
CH3 13.058521 33.974776 -0.470984 -0.000214 -0.002645 -0.002036 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
99 |
|
|
CH3 -0.266605 -16.976512 4.585778 0.000079 0.000030 0.001322 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
100 |
|
|
CH2 -1.005416 -15.909836 5.415213 0.000181 -0.002322 0.004438 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
101 |
|
|
CH2 -2.538283 -16.038256 5.341548 0.000515 -0.003979 0.000374 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
102 |
|
|
CH3 -3.036671 -17.400419 5.858966 -0.000072 -0.004306 -0.001054 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
103 |
|
|
CH3 12.135410 29.993140 -22.699320 -0.006082 0.002304 -0.002847 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
104 |
|
|
CH2 13.014106 29.537555 -23.879123 -0.005754 0.002292 -0.002598 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
105 |
|
|
CH2 14.480142 29.869234 -23.543969 -0.005985 0.001006 -0.000314 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
106 |
|
|
CH3 15.500784 29.491126 -24.633429 0.000740 0.006569 0.004056 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
107 |
|
|
CH3 25.692734 3.335067 3.360105 -0.003670 -0.006396 0.001011 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
108 |
|
|
CH2 24.371116 3.770107 2.700055 -0.003191 -0.004847 0.001072 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
109 |
|
|
CH2 23.176483 2.806490 2.826124 -0.005705 -0.002294 -0.003234 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
110 |
|
|
CH3 23.502290 1.324130 2.565239 -0.002229 -0.001158 -0.005351 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
111 |
|
|
CH3 31.282232 28.259802 -17.524226 -0.002348 -0.002215 -0.004132 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
112 |
|
|
CH2 32.086433 29.511667 -17.921337 0.002603 -0.004186 -0.000320 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
113 |
|
|
CH2 33.258290 29.921138 -17.009919 0.000477 -0.006389 0.003404 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
114 |
|
|
CH3 32.905771 30.209017 -15.538710 -0.003135 0.003980 0.000510 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
115 |
|
|
CH3 15.758966 10.388810 6.940181 0.000959 0.002041 0.000879 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
116 |
|
|
CH2 15.291014 11.848681 6.793900 -0.000512 0.001639 0.001571 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
117 |
|
|
CH2 14.588050 12.304033 8.086222 0.002072 0.000260 0.003463 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
118 |
|
|
CH3 13.877744 13.668648 8.016277 -0.000285 -0.001258 -0.002218 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
119 |
|
|
CH3 14.910465 17.287297 14.075561 -0.001146 0.004616 -0.003809 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
120 |
|
|
CH2 15.541550 17.058416 15.461542 0.002451 0.002849 -0.005739 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
121 |
|
|
CH2 15.081124 15.780806 16.187712 0.003835 0.004101 -0.002658 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
122 |
|
|
CH3 15.825661 15.545813 17.515131 0.000181 0.000377 -0.001267 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
123 |
|
|
CH3 15.870157 15.951116 25.323891 0.002388 -0.004867 -0.002427 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
124 |
|
|
CH2 17.039554 15.577803 26.253808 0.003443 -0.000148 -0.001859 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
125 |
|
|
CH2 16.878513 16.235669 27.636876 -0.000607 -0.000921 -0.001964 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
126 |
|
|
CH3 18.205612 15.941834 28.360800 -0.002751 0.002411 0.003318 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
127 |
|
|
CH3 9.128503 15.495276 19.814574 -0.003356 -0.001665 0.005444 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
128 |
|
|
CH2 9.747209 15.359291 21.218251 -0.000218 0.001921 0.004409 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
129 |
|
|
CH2 11.064377 16.140375 21.381284 -0.000408 0.002330 0.003983 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |
130 |
|
|
CH3 11.520992 16.028228 22.847751 0.005829 0.001137 0.001950 0.0 0.0 0.0 0.0 0.0 0.0 0.0 |