0 mol 129 unq 0 iso 0 dist 7.28273 7.26955 7.07421 10.0627 9.31543 5.04019 numMergedOcc 0
1 mol 129 unq 1 iso 0 dist 7.28273 7.26955 7.07421 11.8027 8.85652 4.79473 numMergedOcc 0
2 mol 132 unq 0 iso 0 dist 5.52837 9.98904 8.15549 4.78213 8.62632 12.032 numMergedOcc 0
3 mol 133 unq 0 iso 0 dist 8.72732 10.5918 5.12189 5.25744 5.9959 6.95933 numMergedOcc 0
4 mol 133 unq 1 iso 0 dist 8.72732 5.48547 7.50126 5.25744 5.9959 5.30466 numMergedOcc 0
5 mol 146 unq 0 iso 0 dist 6.70014 7.8992 5.36826 3.75935 5.50187 6.11221 numMergedOcc 0
6 mol 146 unq 1 iso 0 dist 6.70014 11.0704 8.50225 3.75935 5.50187 8.01939 numMergedOcc 0
7 mol 173 unq 0 iso 0 dist 8.87968 11.3263 5.97008 10.9596 6.95244 5.48443 numMergedOcc 0
8 mol 173 unq 1 iso 0 dist 8.87968 11.3263 5.97008 8.8578 6.11224 10.2216 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 8.72113 13.0532 9.08767 5.62911 9.77333 11.7104 numMergedOcc 0
10 mol 218 unq 0 iso 0 dist 5.51354 4.80435 9.86417 3.85734 7.9987 5.71044 numMergedOcc 0
11 mol 223 unq 0 iso 0 dist 9.10041 15.4738 9.29204 10.8541 7.5808 11.3121 numMergedOcc 0
12 mol 223 unq 1 iso 0 dist 9.10041 14.4135 9.14789 10.8541 7.5808 13.5418 numMergedOcc 0
13 mol 223 unq 2 iso 0 dist 9.10041 6.59509 7.80764 10.8541 7.5808 7.74459 numMergedOcc 0
14 mol 223 unq 3 iso 0 dist 9.10041 11.687 5.75896 10.8541 7.5808 4.53638 numMergedOcc 0
15 mol 239 unq 0 iso 0 dist 6.17408 12.3365 9.09835 4.21942 5.99355 14.486 numMergedOcc 0
16 mol 239 unq 1 iso 0 dist 6.17408 9.92669 7.21466 4.21942 5.99355 11.8914 numMergedOcc 0
17 mol 239 unq 2 iso 0 dist 6.17602 13.2575 9.09835 3.93622 5.99355 14.486 numMergedOcc 0
18 mol 239 unq 3 iso 0 dist 6.17602 12.0265 7.21466 3.93622 5.99355 11.8914 numMergedOcc 0
19 mol 251 unq 0 iso 0 dist 7.73217 10.3544 8.65339 4.66779 8.07576 10.1422 numMergedOcc 0
20 mol 255 unq 0 iso 0 dist 5.84157 9.69849 9.72048 4.04928 7.58813 9.02405 numMergedOcc 0
21 mol 258 unq 0 iso 0 dist 8.88518 3.7042 6.08181 9.29502 9.6327 6.49094 numMergedOcc 0
22 mol 258 unq 1 iso 0 dist 8.88518 13.1596 7.70189 9.29502 9.6327 8.08023 numMergedOcc 0
23 mol 266 unq 0 iso 0 dist 9.70632 12.8161 9.58577 6.11441 4.93584 7.58368 numMergedOcc 0
24 mol 266 unq 1 iso 0 dist 7.07099 14.7313 9.63694 13.8362 8.95841 6.96111 numMergedOcc 0
25 mol 266 unq 2 iso 0 dist 7.07099 7.14057 6.58277 13.8362 8.95841 11.8531 numMergedOcc 0
26 mol 279 unq 0 iso 0 dist 8.93979 7.27711 8.57035 12.3223 7.03656 7.23238 numMergedOcc 0
27 mol 279 unq 1 iso 0 dist 7.86721 13.271 7.2783 9.50243 9.24104 12.5851 numMergedOcc 0
28 mol 287 unq 0 iso 0 dist 9.04355 14.8194 8.0935 8.83056 7.19568 7.23485 numMergedOcc 0
29 mol 288 unq 0 iso 0 dist 9.04355 14.8194 8.0935 8.83056 7.19568 7.23485 numMergedOcc 0
30 mol 289 unq 0 iso 0 dist 9.04355 14.8194 8.0935 8.83056 7.19568 7.23485 numMergedOcc 0
31 mol 292 unq 0 iso 0 dist 6.91689 5.50245 8.12294 6.5727 6.78424 4.04978 numMergedOcc 0
32 mol 292 unq 1 iso 0 dist 6.91689 5.50245 8.12294 9.68077 7.32002 6.61186 numMergedOcc 0
