0 mol 44 unq 0 iso 0 dist 7.85573 5.84744 9.37301 6.10468 6.21423 11.0139 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 6.70925 9.762 5.17759 11.1443 9.87177 13.7119 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 6.70925 9.762 5.17759 5.04503 8.95756 10.2725 numMergedOcc 0
3 mol 78 unq 0 iso 0 dist 6.02034 7.32064 8.76068 3.93133 6.77808 4.62314 numMergedOcc 0
4 mol 78 unq 1 iso 0 dist 6.02034 5.24136 6.05023 3.93133 6.77808 4.41745 numMergedOcc 0
5 mol 78 unq 2 iso 0 dist 6.02034 6.44687 5.10057 3.93133 6.77808 9.17595 numMergedOcc 0
6 mol 78 unq 3 iso 0 dist 6.02034 5.85007 11.6562 3.93133 6.77808 6.35234 numMergedOcc 0
7 mol 78 unq 4 iso 0 dist 6.77808 4.62314 8.76068 3.93133 6.02034 7.32064 numMergedOcc 0
8 mol 78 unq 5 iso 0 dist 6.77808 4.41745 6.05023 3.93133 6.02034 5.24136 numMergedOcc 0
9 mol 78 unq 6 iso 0 dist 6.77808 6.35234 11.6562 3.93133 6.02034 5.85007 numMergedOcc 0
10 mol 103 unq 0 iso 0 dist 6.67575 4.49975 7.93499 10.3429 8.9889 12.6277 numMergedOcc 0
11 mol 108 unq 0 iso 0 dist 5.52402 9.14068 4.91593 7.80411 6.79804 7.90433 numMergedOcc 0
12 mol 108 unq 1 iso 0 dist 6.79804 7.90433 4.91593 7.80411 5.52402 9.14068 numMergedOcc 0
13 mol 128 unq 0 iso 0 dist 5.4772 9.67042 8.1634 3.57533 7.84607 9.01072 numMergedOcc 0
14 mol 128 unq 1 iso 0 dist 5.4772 7.95999 8.13018 3.57533 7.84607 11.4156 numMergedOcc 0
15 mol 128 unq 2 iso 0 dist 7.84607 9.01072 8.1634 3.57533 5.4772 9.67042 numMergedOcc 0
16 mol 195 unq 0 iso 0 dist 9.0153 9.48766 4.65091 3.98055 9.89207 11.9603 numMergedOcc 0
17 mol 225 unq 0 iso 0 dist 7.0795 9.31012 4.72676 3.3846 9.76251 10.7225 numMergedOcc 0
18 mol 259 unq 0 iso 0 dist 7.97113 4.95855 10.2743 5.25523 8.38479 9.18435 numMergedOcc 0
19 mol 259 unq 1 iso 0 dist 7.97113 7.72489 11.46 5.25523 8.38479 12.3606 numMergedOcc 0
20 mol 259 unq 2 iso 0 dist 5.22111 4.95855 7.06301 5.25523 8.53598 9.18435 numMergedOcc 0
21 mol 259 unq 3 iso 0 dist 5.22111 7.72489 7.80863 5.25523 8.53598 12.3606 numMergedOcc 0
22 mol 264 unq 0 iso 0 dist 9.8799 9.13546 11.217 14.4112 8.05522 18.9052 numMergedOcc 0
23 mol 264 unq 1 iso 0 dist 9.8799 8.7365 9.42483 14.4112 8.05522 16.6488 numMergedOcc 0
24 mol 279 unq 0 iso 0 dist 4.75866 8.41945 11.481 9.52032 7.87072 17.58 numMergedOcc 0
25 mol 283 unq 0 iso 0 dist 8.80418 7.81241 10.5903 10.8201 8.80555 15.0534 numMergedOcc 0
26 mol 283 unq 1 iso 0 dist 8.80418 9.52445 9.41544 10.8201 8.80555 15.6382 numMergedOcc 0
