0 mol 7 unq 0 iso 0 dist 9.32945 6.22805 4.57188 17.302 9.85726 11.0773 5.99355 10.2615 5.72491 14.6803 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.90117 6.22805 6.09254 6.96396 7.21217 7.10621 5.99355 9.80599 5.72491 5.44992 numMergedOcc 0
2 mol 16 unq 0 iso 0 dist 7.88676 7.46752 6.53177 5.66097 5.84479 7.63133 6.76292 11.5401 6.56335 10.454 numMergedOcc 0
3 mol 16 unq 1 iso 0 dist 7.88676 7.46752 6.53177 6.06561 8.67719 5.46498 6.76292 11.5401 6.56335 6.70071 numMergedOcc 0
4 mol 38 unq 0 iso 0 dist 5.86972 8.86547 10.4994 7.46414 9.23576 10.3882 9.36454 14.2413 7.54179 11.5475 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 5.39171 6.30194 5.2774 10.5627 6.89722 6.19304 14.8714 13.0088 8.73253 8.26458 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 9.27355 6.30194 5.44275 10.8067 9.68526 10.2049 14.8714 10.5067 8.73253 15.7304 numMergedOcc 0
7 mol 73 unq 2 iso 0 dist 9.27355 6.30194 5.44275 10.5627 7.26679 6.19304 14.8714 10.5067 8.73253 8.26458 numMergedOcc 0
8 mol 73 unq 3 iso 0 dist 9.27355 6.30194 5.44275 17.4113 9.30776 11.6369 14.8714 10.5067 8.73253 8.35241 numMergedOcc 0
9 mol 73 unq 4 iso 0 dist 8.60363 6.30194 8.0624 10.8067 9.72442 10.2049 14.8714 14.8476 8.73253 15.7304 numMergedOcc 0
10 mol 73 unq 5 iso 0 dist 8.60363 6.30194 8.0624 16.3515 9.02288 14.305 14.8714 14.8476 8.73253 17.5447 numMergedOcc 0
11 mol 220 unq 0 iso 0 dist 7.86207 8.9077 4.90657 10.6943 9.8711 9.23153 5.41948 6.50846 5.45036 6.17628 numMergedOcc 0
12 mol 220 unq 1 iso 0 dist 7.86207 8.9077 4.90657 10.6943 9.8711 9.23153 15.1445 14.8113 9.97586 14.0253 numMergedOcc 0
13 mol 224 unq 0 iso 0 dist 6.6537 7.04127 6.46679 4.55824 9.75313 6.61986 6.23345 11.4439 8.37597 4.59567 numMergedOcc 0
14 mol 224 unq 1 iso 0 dist 9.08719 7.04127 7.85135 4.55824 6.08709 6.61986 6.23345 10.3724 8.37597 4.59567 numMergedOcc 0
15 mol 230 unq 0 iso 0 dist 6.23346 8.56954 5.53578 9.6645 9.54235 13.1006 6.46721 5.51163 9.09271 12.9503 numMergedOcc 0
16 mol 230 unq 1 iso 0 dist 6.23346 9.23938 7.7551 9.6645 9.54235 16.6739 6.46721 5.51163 7.44838 12.9503 numMergedOcc 0
17 mol 248 unq 0 iso 0 dist 8.11968 6.44967 4.53213 9.48478 8.71859 7.69895 4.01898 8.46518 6.17052 5.99459 numMergedOcc 0
18 mol 258 unq 0 iso 0 dist 7.70189 8.81059 9.22664 9.78068 8.58088 6.42289 15.4617 14.7484 7.99477 7.42673 numMergedOcc 0
19 mol 258 unq 1 iso 0 dist 7.70189 8.81059 9.22664 9.78068 8.58088 6.42289 11.0527 13.7217 7.86627 6.44209 numMergedOcc 0
20 mol 258 unq 2 iso 0 dist 7.70189 9.12006 13.0489 9.78068 8.58088 10.1675 11.0527 13.7217 7.93574 6.44209 numMergedOcc 0
21 mol 264 unq 0 iso 0 dist 7.61232 6.80096 5.11257 8.57403 9.01085 11.8809 5.04055 9.66538 6.42588 13.4936 numMergedOcc 0
22 mol 264 unq 1 iso 0 dist 7.61232 6.80096 5.11257 8.70128 6.28512 10.6405 5.04055 9.66538 6.42588 12.6928 numMergedOcc 0
