0 mol 0 unq 0 iso 0 dist 8.82102 10.9859 6.91778 8.21826 9.67081 5.8463 numMergedOcc 0
1 mol 11 unq 0 iso 0 dist 6.79478 5.15125 4.30695 4.13124 8.01262 6.03873 numMergedOcc 0
2 mol 11 unq 1 iso 0 dist 6.79478 5.15125 4.30695 13.0674 6.58046 8.84131 numMergedOcc 0
3 mol 11 unq 2 iso 0 dist 6.79478 10.9655 6.35398 4.13124 8.01262 12.9584 numMergedOcc 0
4 mol 11 unq 3 iso 0 dist 6.79478 10.9655 6.35398 13.0674 6.58046 6.51674 numMergedOcc 0
5 mol 43 unq 0 iso 0 dist 9.74445 10.7304 8.95682 5.46849 9.02471 10.4863 numMergedOcc 0
6 mol 58 unq 0 iso 0 dist 9.56737 6.64072 7.68678 13.6875 7.17488 8.76454 numMergedOcc 0
7 mol 81 unq 0 iso 0 dist 9.35818 4.37357 5.65974 7.4961 5.51927 6.27606 numMergedOcc 0
8 mol 92 unq 0 iso 0 dist 7.86724 6.04547 8.18107 3.68007 5.42067 4.30488 numMergedOcc 0
9 mol 92 unq 1 iso 0 dist 7.86724 5.97684 5.9465 3.68007 5.42067 5.09449 numMergedOcc 0
10 mol 102 unq 0 iso 0 dist 9.01767 10.4216 8.31932 8.94532 5.54256 7.28191 numMergedOcc 0
11 mol 102 unq 1 iso 0 dist 9.80678 12.8733 8.31932 6.94341 5.54256 7.28191 numMergedOcc 0
12 mol 114 unq 0 iso 0 dist 8.42445 12.5697 6.84011 13.1958 9.93438 5.99273 numMergedOcc 0
13 mol 119 unq 0 iso 0 dist 9.93703 5.01597 8.99399 8.99475 7.60162 5.77063 numMergedOcc 0
14 mol 122 unq 0 iso 0 dist 8.33083 10.4589 8.88537 12.2092 4.42563 8.90201 numMergedOcc 0
15 mol 122 unq 1 iso 0 dist 8.33083 7.09391 9.23819 12.2092 4.42563 11.3935 numMergedOcc 0
16 mol 130 unq 0 iso 0 dist 8.54461 7.91054 8.78276 4.81304 8.81797 3.88766 numMergedOcc 0
17 mol 130 unq 1 iso 0 dist 7.83619 7.91054 7.96646 4.81304 5.92733 3.88766 numMergedOcc 0
18 mol 130 unq 2 iso 0 dist 9.91643 11.6197 7.96646 11.0219 5.92733 3.88766 numMergedOcc 0
19 mol 131 unq 0 iso 0 dist 8.97145 4.17212 8.70296 5.51548 8.80895 5.92118 numMergedOcc 0
20 mol 131 unq 1 iso 0 dist 8.97145 13.6005 9.25558 5.51548 8.80895 10.2176 numMergedOcc 0
21 mol 131 unq 2 iso 0 dist 6.5874 9.64263 8.70296 5.61122 8.80895 5.92118 numMergedOcc 0
22 mol 131 unq 3 iso 0 dist 6.5874 5.55307 9.25558 5.61122 8.80895 10.2176 numMergedOcc 0
23 mol 174 unq 0 iso 0 dist 8.76218 10.886 8.87569 9.23383 5.61673 6.65209 numMergedOcc 0
24 mol 174 unq 1 iso 0 dist 8.76218 11.8159 9.87122 9.23383 5.61673 9.87207 numMergedOcc 0
25 mol 175 unq 0 iso 0 dist 9.00898 10.5222 9.39352 10.8953 9.19156 11.8094 numMergedOcc 0
26 mol 198 unq 0 iso 0 dist 6.47339 5.47473 6.34616 6.52619 6.77156 4.73496 numMergedOcc 0
27 mol 198 unq 1 iso 0 dist 6.47339 5.47473 6.34616 9.94769 7.97894 4.97547 numMergedOcc 0
28 mol 198 unq 2 iso 0 dist 6.47339 5.47473 6.34616 8.48501 8.08471 5.92533 numMergedOcc 0
29 mol 205 unq 0 iso 0 dist 8.43584 5.42117 4.8668 14.8213 9.31158 9.43113 numMergedOcc 0
30 mol 210 unq 0 iso 0 dist 9.67457 11.6718 7.10826 8.81074 6.85824 4.73037 numMergedOcc 0
31 mol 213 unq 0 iso 0 dist 4.58599 11.5146 8.14332 10.5963 9.09354 13.1121 numMergedOcc 0
32 mol 213 unq 1 iso 0 dist 4.58599 11.5146 8.14332 5.36904 4.66576 6.78109 numMergedOcc 0
33 mol 213 unq 2 iso 0 dist 8.78568 10.693 8.14332 13.711 9.09354 13.1121 numMergedOcc 0
34 mol 213 unq 3 iso 0 dist 8.78568 10.693 8.14332 4.84414 4.66576 6.78109 numMergedOcc 0
35 mol 239 unq 0 iso 0 dist 6.37342 7.48655 8.84636 7.72768 4.43499 5.76503 numMergedOcc 0
36 mol 258 unq 0 iso 0 dist 5.81927 7.15953 7.6595 4.87461 7.12221 4.97531 numMergedOcc 0
37 mol 258 unq 1 iso 0 dist 5.81927 7.15953 7.6595 9.93118 5.4557 7.26991 numMergedOcc 0
38 mol 265 unq 0 iso 0 dist 8.1498 7.43256 6.71375 8.3919 9.28128 12.6979 numMergedOcc 0
39 mol 274 unq 0 iso 0 dist 9.696 14.679 9.85289 10.9841 9.83622 5.14522 numMergedOcc 0
