0 mol 7 unq 0 iso 0 dist 9.8603 9.30196 7.15434 10.9529 9.17482 8.05125 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 7.46102 3.69663 4.92734 5.38703 7.36147 5.41248 numMergedOcc 0
2 mol 8 unq 1 iso 0 dist 9.47227 3.69663 6.26138 5.38703 7.04632 5.41248 numMergedOcc 0
3 mol 8 unq 2 iso 0 dist 9.91301 11.375 6.4754 13.5534 4.62402 7.45665 numMergedOcc 0
4 mol 8 unq 3 iso 0 dist 9.91301 3.69663 6.57999 5.38703 10.1093 5.41248 numMergedOcc 0
5 mol 14 unq 0 iso 0 dist 6.87018 5.41936 6.89209 10.7073 9.85095 8.05352 numMergedOcc 0
6 mol 14 unq 1 iso 0 dist 6.87018 5.41936 6.89209 10.2332 6.83016 8.5032 numMergedOcc 0
7 mol 33 unq 0 iso 0 dist 7.14232 10.8661 9.00543 13.2288 9.81889 8.0346 numMergedOcc 0
8 mol 67 unq 0 iso 0 dist 8.65898 8.93316 8.70949 15.5716 12.5944 9.25638 numMergedOcc 0
9 mol 67 unq 1 iso 0 dist 8.65898 8.93316 8.70949 16.1744 13.0612 8.01856 numMergedOcc 0
10 mol 76 unq 0 iso 0 dist 8.58841 13.4991 5.56964 17.909 9.95835 9.225 numMergedOcc 0
11 mol 86 unq 0 iso 0 dist 8.88225 11.0165 8.40609 16.2616 7.89966 9.67574 numMergedOcc 0
12 mol 86 unq 1 iso 0 dist 9.49308 6.06198 8.40609 13.822 7.89966 9.67574 numMergedOcc 0
13 mol 98 unq 0 iso 0 dist 5.9747 11.1108 8.05602 13.7168 12.5137 5.26536 numMergedOcc 0
14 mol 98 unq 1 iso 0 dist 4.50572 9.17639 8.05602 12.1364 12.5137 5.26536 numMergedOcc 0
15 mol 129 unq 0 iso 0 dist 6.38163 8.56696 6.23966 11.3549 5.12351 7.26325 numMergedOcc 0
16 mol 154 unq 0 iso 0 dist 9.93555 7.19596 8.34737 10.6397 8.32419 4.62366 numMergedOcc 0
17 mol 218 unq 0 iso 0 dist 6.9398 6.7488 4.851 11.6868 5.97687 9.11823 numMergedOcc 0
18 mol 224 unq 0 iso 0 dist 8.39002 4.61429 9.73411 11.4177 11.2298 8.18749 numMergedOcc 0
19 mol 224 unq 1 iso 0 dist 9.2053 4.61429 7.75485 11.4177 5.95421 8.18749 numMergedOcc 0
20 mol 232 unq 0 iso 0 dist 7.70279 5.18593 8.89211 11.4007 10.8978 6.72105 numMergedOcc 0
21 mol 232 unq 1 iso 0 dist 7.70279 5.18593 8.89211 11.9289 10.4487 7.96569 numMergedOcc 0
22 mol 238 unq 0 iso 0 dist 9.66555 5.12308 4.87108 5.83514 10.3683 7.75366 numMergedOcc 0
23 mol 238 unq 1 iso 0 dist 8.67205 4.29839 4.87108 10.0299 10.3683 7.75366 numMergedOcc 0
24 mol 252 unq 0 iso 0 dist 6.1197 9.75362 6.41821 10.5035 4.90903 4.91772 numMergedOcc 0
25 mol 256 unq 0 iso 0 dist 7.67598 4.19031 5.98967 9.99628 4.85574 9.92947 numMergedOcc 0
26 mol 277 unq 0 iso 0 dist 7.88897 5.24499 7.07459 10.4839 12.8864 6.40125 numMergedOcc 0
