0 mol 48 unq 0 iso 0 dist 7.49678 6.17165 6.47086 9.29102 10.1404 6.29782 numMergedOcc 0
1 mol 68 unq 0 iso 0 dist 5.68303 8.56621 9.86454 6.82511 5.08181 5.37935 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 7.52544 9.39338 12.6371 8.26805 5.50078 10.8074 numMergedOcc 0
3 mol 76 unq 1 iso 0 dist 7.52544 9.39338 12.6371 9.68577 11.6055 7.50487 numMergedOcc 0
4 mol 76 unq 2 iso 0 dist 7.52544 8.9053 13.4778 8.26805 5.50078 10.1475 numMergedOcc 0
5 mol 76 unq 3 iso 0 dist 7.52544 8.9053 13.4778 9.68577 11.6055 4.4828 numMergedOcc 0
6 mol 76 unq 4 iso 0 dist 8.08674 9.39338 17.2592 8.26805 11.6853 10.8074 numMergedOcc 0
7 mol 76 unq 5 iso 0 dist 8.08674 9.39338 17.2592 9.68577 15.0489 7.50487 numMergedOcc 0
8 mol 76 unq 6 iso 0 dist 8.08674 8.9053 15.1961 8.26805 11.6853 10.1475 numMergedOcc 0
9 mol 76 unq 7 iso 0 dist 8.08674 8.9053 15.1961 9.68577 15.0489 4.4828 numMergedOcc 0
10 mol 76 unq 8 iso 0 dist 8.33694 9.39338 11.7045 8.26805 4.94673 10.8074 numMergedOcc 0
11 mol 76 unq 9 iso 0 dist 8.33694 9.39338 11.7045 9.68577 5.78236 7.50487 numMergedOcc 0
12 mol 76 unq 10 iso 0 dist 8.33694 8.9053 8.38148 8.26805 4.94673 10.1475 numMergedOcc 0
13 mol 76 unq 11 iso 0 dist 8.33694 8.9053 8.38148 9.68577 5.78236 4.4828 numMergedOcc 0
14 mol 81 unq 0 iso 0 dist 5.14604 8.585 9.22679 7.94697 4.95944 9.75286 numMergedOcc 0
15 mol 103 unq 0 iso 0 dist 8.84955 8.2592 9.13883 7.91691 6.01221 11.5904 numMergedOcc 0
16 mol 168 unq 0 iso 0 dist 8.66519 6.8754 11.0283 8.47439 12.949 8.64743 numMergedOcc 0
17 mol 211 unq 0 iso 0 dist 7.49132 7.03051 6.09386 7.78316 9.54726 12.0324 numMergedOcc 0
18 mol 220 unq 0 iso 0 dist 8.17723 6.61361 9.09461 7.39043 5.05766 10.6705 numMergedOcc 0
19 mol 258 unq 0 iso 0 dist 5.50553 8.94629 11.8626 8.86773 6.4179 14.159 numMergedOcc 0
20 mol 258 unq 1 iso 0 dist 5.50553 8.94629 11.8626 8.95095 11.4354 9.93118 numMergedOcc 0
21 mol 266 unq 0 iso 0 dist 8.78501 9.62474 15.1918 7.51951 15.5294 10.1478 numMergedOcc 0
22 mol 266 unq 1 iso 0 dist 8.78501 8.01441 12.2663 7.51951 15.5294 8.68515 numMergedOcc 0
23 mol 266 unq 2 iso 0 dist 5.59641 9.62474 14.4541 7.51951 12.1427 10.1478 numMergedOcc 0
24 mol 266 unq 3 iso 0 dist 5.59641 8.01441 8.9894 7.51951 12.1427 8.68515 numMergedOcc 0
25 mol 283 unq 0 iso 0 dist 6.28768 8.7902 8.71302 7.58381 10.9892 5.23221 numMergedOcc 0
26 mol 283 unq 1 iso 0 dist 6.28768 7.61141 5.06928 7.58381 10.9892 12.9548 numMergedOcc 0
27 mol 294 unq 0 iso 0 dist 8.92737 7.64578 10.5231 7.33086 8.0693 12.6108 numMergedOcc 0
28 mol 294 unq 1 iso 0 dist 8.92737 7.64578 10.5231 7.88971 9.57892 14.8518 numMergedOcc 0
29 mol 294 unq 2 iso 0 dist 8.92737 7.64578 10.5231 6.82335 10.0639 10.2032 numMergedOcc 0
30 mol 294 unq 3 iso 0 dist 8.92737 6.28096 13.1133 7.33086 8.0693 6.89306 numMergedOcc 0
31 mol 294 unq 4 iso 0 dist 8.92737 6.28096 13.1133 7.88971 9.57892 9.62266 numMergedOcc 0
32 mol 294 unq 5 iso 0 dist 8.92737 6.28096 13.1133 6.82335 10.0639 5.33113 numMergedOcc 0
33 mol 294 unq 6 iso 0 dist 7.15278 5.85292 10.5231 9.32126 8.0693 12.6108 numMergedOcc 0
34 mol 294 unq 7 iso 0 dist 7.15278 5.85292 10.5231 9.38111 9.57892 14.8518 numMergedOcc 0
35 mol 294 unq 8 iso 0 dist 7.15278 5.85292 10.5231 9.14005 10.0639 10.2032 numMergedOcc 0
