0 mol 16 unq 0 iso 0 dist 9.56648 5.48395 5.84479 6.36377 5.35079 6.31718 9.8871 6.04677 8.43054 4.65873 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 9.56648 5.48395 5.84479 12.9591 6.53177 7.63133 9.8871 6.04677 8.43054 9.81307 numMergedOcc 0
2 mol 38 unq 0 iso 0 dist 9.94799 15.3073 9.23576 16.11 7.35595 7.50293 11.8162 4.57886 7.26639 4.40004 numMergedOcc 0
3 mol 38 unq 1 iso 0 dist 9.94799 15.3073 9.23576 18.5085 8.59794 9.91611 11.8162 4.57886 7.26639 8.68364 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 5.70814 6.8958 6.48625 7.7978 6.34264 7.17396 11.5355 11.1377 6.56212 7.31539 numMergedOcc 0
5 mol 59 unq 1 iso 0 dist 5.70814 6.8958 6.48625 10.3954 5.30842 9.21998 11.5355 11.1377 6.56212 11.1607 numMergedOcc 0
6 mol 59 unq 2 iso 0 dist 5.58384 5.85228 6.48625 9.55751 6.34264 7.17396 11.9689 11.1377 6.56212 7.31539 numMergedOcc 0
7 mol 59 unq 3 iso 0 dist 5.58384 5.85228 6.48625 10.7234 5.30842 9.21998 11.9689 11.1377 6.56212 11.1607 numMergedOcc 0
8 mol 92 unq 0 iso 0 dist 9.93688 4.71849 9.514 11.0291 11.8037 7.4729 10.1309 12.7532 8.3773 4.46885 numMergedOcc 0
9 mol 92 unq 1 iso 0 dist 9.88184 9.24395 9.514 16.1796 11.8037 7.4729 16.6066 12.7532 8.3773 4.46885 numMergedOcc 0
10 mol 109 unq 0 iso 0 dist 7.66832 9.47324 8.21889 8.73648 5.5332 7.34473 13.543 10.4255 6.29161 6.73011 numMergedOcc 0
11 mol 109 unq 1 iso 0 dist 7.66832 9.47324 8.21889 8.73648 5.5332 7.34473 17.3399 14.5244 7.86666 13.0886 numMergedOcc 0
12 mol 109 unq 2 iso 0 dist 8.11083 12.7688 8.21889 12.2141 5.5332 7.34473 17.2658 10.4255 6.29161 6.73011 numMergedOcc 0
13 mol 109 unq 3 iso 0 dist 8.11083 12.7688 8.21889 12.2141 5.5332 7.34473 20.0893 14.5244 7.86666 13.0886 numMergedOcc 0
14 mol 117 unq 0 iso 0 dist 6.81489 10.0087 7.70533 12.479 6.29427 9.84395 12.4075 6.66127 6.10127 6.57678 numMergedOcc 0
15 mol 117 unq 1 iso 0 dist 6.81489 10.0087 7.70533 17.1533 14.3476 7.90328 12.4075 6.66127 6.10127 10.5783 numMergedOcc 0
16 mol 117 unq 2 iso 0 dist 9.33403 13.5681 9.85576 11.3462 10.4589 7.90328 17.3823 12.4378 8.84018 7.20875 numMergedOcc 0
17 mol 117 unq 3 iso 0 dist 9.33403 13.5681 9.85576 17.9437 14.2649 7.83136 17.3823 12.4378 8.84018 3.77029 numMergedOcc 0
18 mol 117 unq 4 iso 0 dist 9.33403 13.5681 9.85576 16.6362 9.53886 7.0603 17.3823 12.4378 8.84018 5.21535 numMergedOcc 0
19 mol 119 unq 0 iso 0 dist 6.67306 8.8283 9.42766 16.7151 14.0677 8.73993 15.3779 16.57 7.64052 9.68677 numMergedOcc 0
20 mol 127 unq 0 iso 0 dist 8.88979 6.09267 8.40046 13.6355 9.75166 9.30299 10.6292 12.1959 6.08673 12.8087 numMergedOcc 0
21 mol 129 unq 0 iso 0 dist 8.63018 5.56946 6.29026 13.5311 11.5533 8.54584 8.09774 4.79473 5.51197 12.1739 numMergedOcc 0
22 mol 129 unq 1 iso 0 dist 8.63018 5.56946 6.29026 13.5311 11.5533 8.54584 11.4776 5.04019 6.69691 8.26896 numMergedOcc 0
23 mol 129 unq 2 iso 0 dist 8.63018 5.56946 6.29026 13.5311 11.5533 8.54584 14.427 10.1802 8.86944 5.63254 numMergedOcc 0
24 mol 205 unq 0 iso 0 dist 6.09754 4.78067 8.43584 13.2374 12.4616 9.61492 10.867 14.6356 6.49765 10.6504 numMergedOcc 0
25 mol 205 unq 1 iso 0 dist 6.09754 4.78067 8.43584 9.34594 10.6123 7.45763 10.867 14.6356 6.49765 8.67921 numMergedOcc 0
26 mol 238 unq 0 iso 0 dist 9.46728 9.23693 5.24313 14.9617 12.1448 7.31233 8.56975 12.4194 9.12776 10.3162 numMergedOcc 0
27 mol 238 unq 1 iso 0 dist 9.91921 4.7157 9.31417 6.2365 6.62361 5.72887 10.5721 13.338 9.72188 7.06793 numMergedOcc 0
28 mol 238 unq 2 iso 0 dist 8.20243 4.7157 5.56719 6.2365 5.96552 5.72887 10.5721 12.046 9.72188 7.06793 numMergedOcc 0
29 mol 259 unq 0 iso 0 dist 5.98006 6.64729 6.77279 12.3391 7.55268 8.53687 13.9131 9.90573 9.07743 6.73882 numMergedOcc 0
30 mol 259 unq 1 iso 0 dist 5.98006 6.64729 6.77279 8.06771 5.71237 8.13497 13.9131 9.90573 9.07743 8.8603 numMergedOcc 0
31 mol 259 unq 2 iso 0 dist 5.98006 9.79538 9.58006 8.06771 5.71237 7.88519 14.2921 12.7528 9.63573 7.20604 numMergedOcc 0
32 mol 259 unq 3 iso 0 dist 5.98006 9.79538 9.58006 8.06771 5.71237 7.88519 13.9131 9.90573 7.66153 8.8603 numMergedOcc 0
33 mol 259 unq 4 iso 0 dist 5.98006 9.79538 9.58006 12.3795 9.10984 7.84554 14.2921 12.7528 9.63573 5.05362 numMergedOcc 0
34 mol 259 unq 5 iso 0 dist 5.98006 9.79538 9.58006 12.3795 9.10984 7.84554 13.9131 9.90573 7.66153 5.8801 numMergedOcc 0
35 mol 259 unq 6 iso 0 dist 5.98006 9.79538 9.58006 11.1503 11.8501 7.46176 14.2921 12.7528 9.63573 5.21606 numMergedOcc 0
36 mol 259 unq 7 iso 0 dist 5.98006 9.79538 9.58006 11.1503 11.8501 7.46176 13.9131 9.90573 7.66153 11.8896 numMergedOcc 0
37 mol 259 unq 8 iso 0 dist 5.98006 9.79538 9.58006 17.0226 13.9868 9.18903 14.2921 12.7528 9.63573 7.46841 numMergedOcc 0
38 mol 259 unq 9 iso 0 dist 5.98006 9.79538 9.58006 17.0226 13.9868 9.18903 13.9131 9.90573 7.66153 5.81576 numMergedOcc 0
39 mol 259 unq 10 iso 0 dist 5.22111 5.41945 7.93997 10.5892 14.8465 7.46176 4.95855 7.06301 5.85442 10.067 numMergedOcc 0
40 mol 259 unq 11 iso 0 dist 5.22111 5.41945 7.93997 10.5892 14.8465 7.46176 7.72489 7.80863 6.95511 11.6988 numMergedOcc 0
41 mol 259 unq 12 iso 0 dist 8.53598 10.2837 7.93997 13.5637 14.8465 7.46176 9.18435 7.06301 5.85442 10.067 numMergedOcc 0
42 mol 259 unq 13 iso 0 dist 8.53598 10.2837 7.93997 13.5637 14.8465 7.46176 12.3606 7.80863 6.95511 11.6988 numMergedOcc 0
