21 lines
1.4 KiB
Plaintext
21 lines
1.4 KiB
Plaintext
18
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Coordinates from ORCA-job orca E -310.170564223124
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C 3.99917268867994 -0.91750235352916 0.85333020401396
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C 2.79763044937488 -0.68580901157137 0.26755204859600
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C 1.59548849753855 -0.30967889073215 0.97563552650653
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C 0.38535715720948 -0.07715218982943 0.37672248375569
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C -0.80577914627901 0.29731050070966 1.09226357401209
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C -2.04655399490727 0.54572830538493 0.55755871435778
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C -2.41539778116011 0.48275740422570 -0.84047356704870
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C -3.66210713881010 0.74233631932887 -1.30799116790201
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H 4.88339140580281 -1.20178354435375 0.26390412860041
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H 4.12818585307349 -0.82773362012219 1.94458438282309
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H 2.70899704002782 -0.78615134350532 -0.82981367020279
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H 1.67129727521682 -0.20582408215889 2.07394724061866
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H 0.32528284591856 -0.18474677314834 -0.72057246741106
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H -0.69761134700729 0.39182734378297 2.18693249790322
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H -2.85567243656092 0.82383238910480 1.25509726481811
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H -1.63057261156313 0.20654108930665 -1.56578473381203
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H -3.90031613994436 0.68342776238182 -2.38041714498091
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H -4.48079561661016 1.02262169472520 -0.62451731464802
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