0 mol 5 unq 0 iso 0 dist 5.04052 7.0627 3.33561 4.69173 5.2392 4.9568 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 9.72136 9.942 3.7765 5.79552 10.2405 8.79378 numMergedOcc 0
2 mol 46 unq 1 iso 0 dist 9.72136 9.942 3.7765 14.6072 13.5087 9.7691 numMergedOcc 0
3 mol 46 unq 2 iso 0 dist 4.61355 9.942 9.44812 5.79552 8.55202 8.79378 numMergedOcc 0
4 mol 46 unq 3 iso 0 dist 4.61355 9.942 9.44812 14.6072 13.6147 9.7691 numMergedOcc 0
5 mol 62 unq 0 iso 0 dist 5.92285 6.42645 5.98227 3.91116 7.30651 7.25138 numMergedOcc 0
6 mol 62 unq 1 iso 0 dist 8.38687 6.42645 5.87787 3.91116 11.2695 7.25138 numMergedOcc 0
7 mol 83 unq 0 iso 0 dist 6.61587 6.72584 3.31218 10.5201 12.7092 9.94528 numMergedOcc 0
8 mol 83 unq 1 iso 0 dist 6.61587 6.72584 3.31218 7.36012 10.3095 8.94777 numMergedOcc 0
9 mol 83 unq 2 iso 0 dist 6.61587 6.72584 3.31218 14.1233 12.4838 9.47551 numMergedOcc 0
10 mol 83 unq 3 iso 0 dist 8.24464 6.72584 9.11262 10.5201 16.9209 9.94528 numMergedOcc 0
11 mol 83 unq 4 iso 0 dist 8.24464 6.72584 9.11262 7.36012 12.6206 8.94777 numMergedOcc 0
12 mol 83 unq 5 iso 0 dist 8.24464 6.72584 9.11262 14.1233 18.4418 9.47551 numMergedOcc 0
13 mol 103 unq 0 iso 0 dist 9.43076 7.85115 14.3087 6.21393 15.0349 5.53454 numMergedOcc 0
14 mol 123 unq 0 iso 0 dist 8.36221 8.09329 11.5607 7.43229 15.3137 8.30974 numMergedOcc 0
15 mol 123 unq 1 iso 0 dist 8.6441 6.13025 11.5607 7.19969 15.3137 8.30974 numMergedOcc 0
16 mol 133 unq 0 iso 0 dist 7.09831 7.84085 5.87276 9.45934 10.2321 4.82356 numMergedOcc 0
17 mol 133 unq 1 iso 0 dist 7.09831 7.84085 5.87276 5.10912 10.9863 8.83476 numMergedOcc 0
18 mol 168 unq 0 iso 0 dist 4.68544 8.1953 8.60565 12.8199 14.6843 6.48066 numMergedOcc 0
19 mol 168 unq 1 iso 0 dist 4.68544 8.16253 5.62227 15.3661 12.4546 8.47543 numMergedOcc 0
20 mol 169 unq 0 iso 0 dist 8.79644 8.80004 3.18152 11.1188 10.7469 7.78577 numMergedOcc 0
21 mol 171 unq 0 iso 0 dist 9.34557 8.25547 3.51753 7.58118 10.1325 7.06555 numMergedOcc 0
22 mol 171 unq 1 iso 0 dist 8.83844 8.25547 7.20382 7.58118 6.51523 7.06555 numMergedOcc 0
23 mol 184 unq 0 iso 0 dist 9.53656 9.35481 14.4056 7.11382 14.5729 7.65214 numMergedOcc 0
24 mol 184 unq 1 iso 0 dist 7.06562 9.35481 5.54499 7.11382 9.7679 7.65214 numMergedOcc 0
25 mol 214 unq 0 iso 0 dist 8.9694 6.03628 5.22858 7.73947 13.851 9.68612 numMergedOcc 0
26 mol 237 unq 0 iso 0 dist 6.16312 5.27463 5.88058 5.61195 11.2619 7.69237 numMergedOcc 0
27 mol 285 unq 0 iso 0 dist 7.63933 6.94666 3.14843 6.61129 8.27917 6.73396 numMergedOcc 0
28 mol 287 unq 0 iso 0 dist 7.74312 8.08382 3.66473 7.88871 10.251 7.84189 numMergedOcc 0
29 mol 288 unq 0 iso 0 dist 7.74312 8.08382 3.66473 7.88871 10.251 7.84189 numMergedOcc 0
30 mol 289 unq 0 iso 0 dist 7.74312 8.08382 3.66473 7.88871 10.251 7.84189 numMergedOcc 0
