0 mol 45 unq 0 iso 0 dist 4.5673 6.87036 3.61653 5.27432 5.2315 5.31095 numMergedOcc 0
1 mol 62 unq 0 iso 0 dist 9.79863 7.61377 5.77803 6.20622 11.6431 6.52537 numMergedOcc 0
2 mol 63 unq 0 iso 0 dist 5.55574 6.89855 7.1742 4.10935 9.49232 9.58748 numMergedOcc 0
3 mol 88 unq 0 iso 0 dist 7.01545 5.6516 5.46401 5.05425 11.6928 9.06249 numMergedOcc 0
4 mol 114 unq 0 iso 0 dist 4.86767 7.4113 3.67473 5.27337 5.32751 5.45716 numMergedOcc 0
5 mol 124 unq 0 iso 0 dist 9.18949 8.50362 9.91987 16.6005 17.4515 9.0745 numMergedOcc 0
6 mol 141 unq 0 iso 0 dist 8.46376 8.12558 10.3222 4.80049 10.7925 4.70342 numMergedOcc 0
7 mol 152 unq 0 iso 0 dist 8.49831 9.07315 11.2086 6.30341 12.6101 9.981 numMergedOcc 0
8 mol 152 unq 1 iso 0 dist 8.49831 9.07315 11.2086 13.95 17.6179 7.78215 numMergedOcc 0
9 mol 194 unq 0 iso 0 dist 8.09776 9.81055 15.4151 11.6792 12.8521 8.93352 numMergedOcc 0
10 mol 194 unq 1 iso 0 dist 5.4455 9.81055 7.29209 11.6792 10.4112 8.93352 numMergedOcc 0
11 mol 233 unq 0 iso 0 dist 9.83883 8.2484 5.24709 9.28737 13.0877 8.07857 numMergedOcc 0
12 mol 252 unq 0 iso 0 dist 7.60896 9.09279 10.3958 7.39922 10.4632 8.63893 numMergedOcc 0
13 mol 253 unq 0 iso 0 dist 8.64294 9.80396 5.35601 11.7444 12.1271 9.01486 numMergedOcc 0
14 mol 254 unq 0 iso 0 dist 7.00841 5.83039 4.4384 9.92619 9.43169 6.56151 numMergedOcc 0
15 mol 254 unq 1 iso 0 dist 7.00841 5.83039 4.4384 6.33436 5.9438 6.58752 numMergedOcc 0
16 mol 254 unq 2 iso 0 dist 7.00841 6.74364 6.09569 9.92619 9.43169 8.3417 numMergedOcc 0
17 mol 266 unq 0 iso 0 dist 6.77259 7.36137 4.60397 5.62596 9.60449 8.53393 numMergedOcc 0
18 mol 266 unq 1 iso 0 dist 6.77259 4.95415 5.26919 5.62596 9.60449 7.24165 numMergedOcc 0
19 mol 284 unq 0 iso 0 dist 4.87349 8.2236 9.94624 16.0873 17.2626 8.82497 numMergedOcc 0
