0 mol 8 unq 0 iso 0 dist 5.41248 4.92734 7.36147 7.35767 12.5407 8.96553 7.0822 8.79697 8.33604 8.27181 numMergedOcc 0
1 mol 61 unq 0 iso 0 dist 7.77128 9.70415 16.1373 5.46309 12.841 6.65721 10.4362 18.127 8.76003 5.83489 numMergedOcc 0
2 mol 61 unq 1 iso 0 dist 7.77128 9.70415 16.1373 11.9897 18.5951 6.72123 10.4362 18.127 8.76003 7.39396 numMergedOcc 0
3 mol 86 unq 0 iso 0 dist 9.67574 8.40609 7.89966 9.54732 14.5863 9.5497 6.82648 6.13833 7.79359 9.68893 numMergedOcc 0
4 mol 100 unq 0 iso 0 dist 8.09751 5.70279 11.3776 5.92158 9.27725 7.47343 11.8754 16.8739 7.75343 15.209 numMergedOcc 0
5 mol 100 unq 1 iso 0 dist 8.09751 5.70279 11.3776 5.85449 13.9516 6.65086 11.8754 16.8739 7.75343 10.9608 numMergedOcc 0
6 mol 100 unq 2 iso 0 dist 8.09751 5.70279 11.3776 7.68675 13.081 6.56369 11.8754 16.8739 7.75343 5.69137 numMergedOcc 0
7 mol 100 unq 3 iso 0 dist 8.09751 5.70279 11.3776 9.53223 17.0478 9.30209 11.8754 16.8739 7.75343 9.21622 numMergedOcc 0
8 mol 115 unq 0 iso 0 dist 9.47253 8.97043 10.1455 11.8721 17.1394 9.33865 7.266 13.8651 9.66954 6.09023 numMergedOcc 0
9 mol 115 unq 1 iso 0 dist 9.47253 8.97043 10.1455 11.8721 17.1394 9.33865 11.6637 16.5317 7.64585 10.2377 numMergedOcc 0
10 mol 115 unq 2 iso 0 dist 9.47253 8.97043 10.1455 5.19652 9.54842 6.11741 7.266 13.8651 9.66954 4.61908 numMergedOcc 0
11 mol 115 unq 3 iso 0 dist 9.47253 8.97043 10.1455 5.19652 9.54842 6.11741 11.6637 16.5317 7.64585 10.8939 numMergedOcc 0
12 mol 155 unq 0 iso 0 dist 8.3622 5.68636 8.78324 7.92939 14.5301 6.43582 7.441 9.77059 9.38946 12.8482 numMergedOcc 0
13 mol 155 unq 1 iso 0 dist 8.3622 5.68636 8.78324 7.92939 14.5301 6.43582 6.79302 12.5457 7.36102 8.27726 numMergedOcc 0
14 mol 209 unq 0 iso 0 dist 6.74526 6.14896 7.34962 9.80484 14.282 7.56373 4.86181 11.452 7.95911 7.19056 numMergedOcc 0
15 mol 209 unq 1 iso 0 dist 8.12326 6.14896 7.61997 9.80484 13.2724 7.56373 4.86181 12.0666 7.95911 7.19056 numMergedOcc 0
16 mol 209 unq 2 iso 0 dist 8.68691 9.12289 7.34962 11.2544 14.282 7.56373 7.37293 11.452 7.95911 7.19056 numMergedOcc 0
17 mol 209 unq 3 iso 0 dist 7.37014 9.12289 7.61997 11.2544 13.2724 7.56373 7.37293 12.0666 7.95911 7.19056 numMergedOcc 0
18 mol 222 unq 0 iso 0 dist 7.99609 8.5834 9.69122 5.01062 7.73634 7.54212 4.78647 11.3246 7.18956 7.61682 numMergedOcc 0
19 mol 224 unq 0 iso 0 dist 8.18749 9.73411 11.2298 14.1073 18.8009 8.95269 9.9234 15.167 6.87664 7.98696 numMergedOcc 0
20 mol 224 unq 1 iso 0 dist 8.18749 9.73411 11.2298 9.81806 14.526 6.57273 9.9234 15.167 6.87664 7.12232 numMergedOcc 0
21 mol 224 unq 2 iso 0 dist 8.18749 9.73411 11.2298 5.99647 10.0508 5.78342 9.9234 15.167 6.87664 5.3621 numMergedOcc 0
22 mol 238 unq 0 iso 0 dist 7.75366 4.87108 10.3683 7.45873 14.2408 6.22714 5.61491 10.8592 7.49471 5.17471 numMergedOcc 0
23 mol 238 unq 1 iso 0 dist 7.75366 7.64276 10.313 7.45873 14.2408 7.31233 13.9044 16.4925 6.55759 10.4664 numMergedOcc 0
24 mol 238 unq 2 iso 0 dist 7.75366 7.64276 10.313 7.45873 14.2408 7.31233 13.3748 14.4244 7.02475 11.2717 numMergedOcc 0
25 mol 238 unq 3 iso 0 dist 7.75366 7.64276 10.313 7.45873 14.2408 7.31233 11.6924 10.2886 7.67322 12.6986 numMergedOcc 0
26 mol 238 unq 4 iso 0 dist 7.75366 7.64276 10.313 7.45873 14.2408 7.31233 5.61491 10.8592 7.19008 5.17471 numMergedOcc 0
27 mol 256 unq 0 iso 0 dist 9.92947 5.98967 4.85574 6.64029 12.7898 8.29103 6.25507 9.92048 5.24676 4.22352 numMergedOcc 0
