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Copy patht102-zmatrixMove
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t102-zmatrixMove
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ZMatrixMove
Ru
Cl 1 0.011322
Cl 1 -0.004582 2 -0.054
Cl 1 0.000266 3 -0.607 2 -0.697 -1
C 1 0.003556 3 4.134 4 0.416 1
H 5 -0.000928 1 -1.278 3 1.277 0
H 5 0.000416 1 1.324 6 -0.086 -1
C 1 -0.005993 3 -3.576 4 -1.862 -1
N 8 -0.002473 1 0.283 3 19.382 0
C 9 -0.000223 8 2.603 1 -6.552 0
C 10 -0.001845 9 -0.093 8 5.968 0
C 11 0.002372 10 0.078 9 10.099 0
H 12 0.000019 11 -0.054 10 -1.769 0
C 12 -0.003592 11 -0.089 13 0.159 1
C 14 0.001534 12 0.124 11 -3.582 0
H 15 0.000303 14 -0.018 12 1.985 0
C 15 -0.002961 14 0.054 16 -0.017 1
C 17 -0.001116 15 0.080 14 -2.389 0
H 18 -0.000928 17 -0.232 15 8.156 0
H 18 0.000053 17 -0.004 19 0.322 1
H 18 0.000687 17 0.011 19 0.051 -1
C 14 0.001151 12 0.743 15 -0.839 -1
H 22 -0.000666 14 0.160 12 38.303 0
H 22 -0.001500 14 1.015 23 0.407 -1
H 22 0.001933 14 -0.632 24 -0.410 -1
C 11 -0.000338 10 -0.092 12 0.054 1
H 26 0.000020 11 0.177 10 1.752 0
H 26 0.001364 11 0.201 27 0.193 1
H 26 0.000220 11 0.008 27 0.104 -1
C 9 0.000546 10 -2.889 11 -0.119 0
H 30 -0.001281 9 0.041 10 -1.264 0
H 30 0.001313 9 -0.492 31 -0.214 1
C 30 -0.000582 9 0.422 31 0.259 -1
H 33 -0.001077 30 0.131 9 6.861 0
H 33 0.000842 30 -0.046 34 -0.192 -1
N 33 0.000042 30 0.459 34 0.012 1
C 36 -0.000310 33 -2.462 30 -5.439 0
C 37 0.000759 36 -0.630 33 5.115 0
C 38 -0.001006 37 0.171 36 -6.115 0
H 39 0.001418 38 -0.038 37 1.364 0
C 39 0.001981 38 -0.058 40 0.090 -1
C 41 -0.000950 39 -0.045 38 1.461 0
H 42 0.000097 41 -0.085 39 -0.461 0
C 37 -0.000545 36 0.434 38 0.023 -1
C 44 -0.000147 37 0.310 36 4.086 0
H 45 0.000022 44 -0.050 37 2.701 0
H 45 0.001027 44 0.714 46 0.307 1
H 45 -0.000188 44 -0.137 47 -0.901 1
C 41 0.000355 39 0.296 42 -0.250 1
H 49 -0.000153 41 0.026 39 -2.701 0
H 49 -0.000513 41 0.289 50 -0.010 1
H 49 0.000027 41 -0.274 50 -0.073 -1
C 38 0.000078 37 -0.400 39 0.229 1
H 53 -0.000348 38 -0.193 37 -3.202 0
H 53 0.000295 38 -0.295 54 0.129 -1
H 53 0.000316 38 0.413 54 -0.156 1
Ru 1 0.005805 3 -0.129 4 -0.662 1
Cl 57 0.004045 1 0.822 3 -1.502 0
C 57 -0.004640 1 0.974 58 1.085 1
H 59 0.002697 57 -0.904 1 10.967 0
C 59 0.003311 57 3.257 60 -2.337 -1
H 61 0.001969 59 -2.068 57 39.370 0
H 61 -0.010081 59 3.702 62 3.697 1
C 61 -0.002204 59 -5.342 63 2.262 1
C 64 -0.003300 61 1.365 59 -82.168 0
H 65 -0.000391 64 0.159 61 -2.942 0
C 65 0.000301 64 -0.483 66 0.322 1
H 67 -0.001063 65 -0.066 64 0.305 0
C 67 -0.002488 65 0.106 68 -0.041 1
H 69 0.000082 67 0.002 65 -0.281 0
C 69 0.001208 67 0.281 70 -0.282 -1
H 71 0.000103 69 -0.068 67 -0.320 0
Si 71 -0.002162 69 -0.228 72 0.296 1
H 73 0.001913 71 0.888 69 0.184 0
C 57 -0.000598 1 -4.239 58 3.230 -1
N 75 -0.003262 57 0.107 1 -0.564 0
C 76 -0.001371 75 1.147 57 -16.615 0
C 77 0.001574 76 -0.893 75 6.091 0
C 78 -0.002590 77 0.158 76 1.041 0
H 79 -0.000262 78 0.129 77 0.346 0
C 79 0.001463 78 -0.179 80 0.051 -1
C 81 -0.002669 79 -0.030 78 -0.189 0
H 82 -0.001778 81 -0.096 79 -0.313 0
C 82 0.001436 81 0.271 83 -0.176 1
C 84 -0.000504 82 -0.361 81 2.129 0
H 85 -0.000902 84 0.107 82 12.839 0
H 85 -0.000794 84 0.098 86 0.122 -1
H 85 0.001788 84 -0.136 87 0.011 -1
C 81 -0.000453 79 0.254 82 -0.226 1
H 89 0.000081 81 0.123 79 -0.351 0
H 89 -0.000443 81 -0.238 90 0.098 -1
H 89 0.000113 81 -0.069 90 0.076 1
C 78 0.000566 77 -0.152 79 0.020 -1
H 93 -0.000042 78 -0.001 77 2.020 0
H 93 -0.000214 78 0.599 94 0.035 -1
H 93 0.000300 78 -0.643 94 -0.241 1
C 76 -0.000822 75 0.132 77 0.057 -1
H 97 0.000054 76 0.022 75 1.434 0
H 97 0.000029 76 -0.118 98 -0.045 -1
C 97 -0.002117 76 -0.127 98 0.255 1
H 100 -0.000506 97 -0.115 76 -1.417 0
H 100 0.000944 97 0.182 101 -0.068 1
N 75 0.004540 57 -0.436 76 -0.089 -1
C 103 0.000621 75 0.160 57 19.598 0
C 104 -0.001213 103 -0.511 75 -10.873 0
C 105 0.003208 104 0.132 103 -3.122 0
H 106 0.000100 105 -0.092 104 0.801 0
C 106 -0.001659 105 -0.089 107 0.181 1
C 108 0.002930 106 -0.060 105 -0.587 0
H 109 0.000399 108 -0.017 106 0.690 0
C 109 -0.001186 108 0.130 110 -0.103 1
C 111 -0.000958 109 0.100 108 2.056 0
H 112 0.000438 111 -0.353 109 -8.522 0
H 112 -0.000222 111 -0.015 113 -0.140 1
H 112 -0.001495 111 0.237 113 -0.052 -1
C 108 0.001367 106 0.775 109 -0.742 -1
H 116 -0.001921 108 0.451 106 -28.572 0
H 116 0.002022 108 -0.018 117 -0.165 1
H 116 0.000770 108 -0.052 117 0.155 -1
C 105 -0.000001 104 0.142 106 -0.335 -1
H 120 -0.000291 105 0.161 104 -10.614 0
H 120 -0.001270 105 0.654 121 0.452 1
H 120 0.001646 105 -0.634 122 -0.622 1
$$$$