0 mol 9 unq 0 iso 0 dist 6.85412 5.60154 9.29529 6.33889 5.80437 7.2199 9.62394 4.45625 9.57198 6.0397 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 6.33889 5.60154 7.2199 6.85412 5.80437 9.29529 9.62394 6.0397 9.57198 4.45625 numMergedOcc 0
2 mol 45 unq 0 iso 0 dist 7.06308 9.01651 8.59109 14.3965 14.5783 8.13782 10.862 8.70414 5.55096 6.39184 numMergedOcc 0
3 mol 45 unq 1 iso 0 dist 6.34173 6.89191 8.59109 14.4997 14.5783 8.13782 10.6216 8.70414 5.55096 6.39184 numMergedOcc 0
4 mol 45 unq 2 iso 0 dist 9.43442 5.54436 8.59109 11.2545 14.5783 8.13782 9.53378 8.70414 5.55096 6.39184 numMergedOcc 0
5 mol 45 unq 3 iso 0 dist 6.99408 7.39653 8.13782 15.6951 14.5783 8.59109 9.49841 6.39184 5.55096 8.70414 numMergedOcc 0
6 mol 45 unq 4 iso 0 dist 9.3403 10.6095 8.13782 19.075 14.5783 8.59109 13.505 6.39184 5.55096 8.70414 numMergedOcc 0
7 mol 58 unq 0 iso 0 dist 9.33535 6.78077 8.80108 10.8928 7.57085 6.50297 13.2397 10.8421 8.71468 11.3634 numMergedOcc 0
8 mol 58 unq 1 iso 0 dist 8.26899 6.75888 8.80108 11.3177 7.57085 6.50297 7.21955 10.8421 8.71468 11.3634 numMergedOcc 0
9 mol 58 unq 2 iso 0 dist 9.58673 6.47744 7.01363 12.4575 6.49184 6.96494 8.80614 8.88332 9.11258 13.4366 numMergedOcc 0
10 mol 114 unq 0 iso 0 dist 6.73814 12.1324 9.86739 17.4431 12.0339 9.49413 9.39063 6.76585 8.809 13.9603 numMergedOcc 0
11 mol 115 unq 0 iso 0 dist 7.64585 10.7942 6.40036 12.0409 9.37623 7.99631 13.3009 5.67953 7.70313 11.4407 numMergedOcc 0
12 mol 141 unq 0 iso 0 dist 6.93652 7.57216 6.2135 15.487 10.8776 8.55681 9.79216 5.39904 5.52683 6.76437 numMergedOcc 0
13 mol 141 unq 1 iso 0 dist 9.54444 6.96143 6.2135 15.384 10.8776 8.55681 11.7726 5.39904 5.52683 6.76437 numMergedOcc 0
14 mol 155 unq 0 iso 0 dist 9.17284 6.3845 6.51096 13.2459 6.0706 8.73171 10.9606 7.6506 9.0529 6.00473 numMergedOcc 0
15 mol 155 unq 1 iso 0 dist 9.87281 5.48883 6.51096 8.27111 6.0706 8.73171 8.69157 7.6506 9.0529 6.00473 numMergedOcc 0
16 mol 155 unq 2 iso 0 dist 8.87452 5.77564 6.51096 7.68368 6.0706 8.73171 10.8572 7.6506 9.0529 6.00473 numMergedOcc 0
17 mol 155 unq 3 iso 0 dist 8.27111 5.48883 8.73171 9.87281 6.0706 6.51096 8.69157 6.00473 9.0529 7.6506 numMergedOcc 0
18 mol 155 unq 4 iso 0 dist 7.68368 5.77564 8.73171 8.87452 6.0706 6.51096 10.8572 6.00473 9.0529 7.6506 numMergedOcc 0
19 mol 181 unq 0 iso 0 dist 6.94688 8.25067 8.20656 6.71012 5.3528 9.40622 8.90963 4.43678 5.95304 6.03415 numMergedOcc 0
20 mol 181 unq 1 iso 0 dist 6.71012 8.25067 9.40622 6.94688 5.3528 8.20656 8.90963 6.03415 5.95304 4.43678 numMergedOcc 0
21 mol 234 unq 0 iso 0 dist 6.16063 5.9221 8.49841 11.4691 10.9755 9.6101 7.32499 7.17691 7.43663 4.51304 numMergedOcc 0
22 mol 250 unq 0 iso 0 dist 8.80086 11.0402 7.88284 11.0437 6.59053 5.94383 15.9848 9.48491 6.44252 6.40578 numMergedOcc 0
