0 mol 28 unq 0 iso 0 dist 9.83168 8.40467 13.4544 10.8781 12.676 8.95552 numMergedOcc 0
1 mol 37 unq 0 iso 0 dist 5.98359 6.84257 8.49523 5.8086 11.7919 9.49441 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 7.02351 6.85356 4.63063 5.41354 9.67601 8.49022 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 7.53504 7.32265 8.30433 15.5344 15.089 8.49022 numMergedOcc 0
4 mol 73 unq 2 iso 0 dist 8.66342 7.32265 4.63063 15.5344 9.67601 8.49022 numMergedOcc 0
5 mol 73 unq 3 iso 0 dist 7.21285 7.32265 4.68175 15.5344 11.9113 8.49022 numMergedOcc 0
6 mol 73 unq 4 iso 0 dist 6.95094 7.32265 10.0459 15.5344 18.1632 8.49022 numMergedOcc 0
7 mol 86 unq 0 iso 0 dist 9.64554 8.42594 10.2202 6.65686 13.6862 6.54726 numMergedOcc 0
8 mol 87 unq 0 iso 0 dist 8.33989 7.10886 5.80857 5.10607 11.9633 9.64421 numMergedOcc 0
9 mol 87 unq 1 iso 0 dist 8.33989 7.83828 10.5488 5.10607 11.9633 6.72471 numMergedOcc 0
10 mol 90 unq 0 iso 0 dist 8.6308 7.94379 5.12529 4.74096 9.05357 8.95044 numMergedOcc 0
11 mol 105 unq 0 iso 0 dist 9.87685 9.96269 8.60755 7.9126 12.6708 6.88308 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 6.89564 9.82274 5.32245 13.5772 10.1372 7.46812 numMergedOcc 0
13 mol 152 unq 0 iso 0 dist 7.99446 9.54774 8.8525 7.8634 13.8466 9.08475 numMergedOcc 0
14 mol 152 unq 1 iso 0 dist 7.21636 9.54774 12.5216 7.8634 14.56 9.08475 numMergedOcc 0
15 mol 183 unq 0 iso 0 dist 9.82833 9.84649 9.01399 12.0052 16.5717 8.55287 numMergedOcc 0
16 mol 193 unq 0 iso 0 dist 9.16852 7.71716 3.53549 11.477 7.20955 9.53066 numMergedOcc 0
17 mol 193 unq 1 iso 0 dist 5.19654 8.71993 3.53549 6.6036 7.20955 9.53066 numMergedOcc 0
18 mol 224 unq 0 iso 0 dist 9.92947 5.07376 12.9085 5.56344 13.1552 7.26162 numMergedOcc 0
19 mol 224 unq 1 iso 0 dist 7.46044 5.07376 4.49347 5.56344 9.04427 7.26162 numMergedOcc 0
20 mol 224 unq 2 iso 0 dist 9.06201 8.96263 9.9943 12.6215 13.7471 7.49889 numMergedOcc 0
21 mol 224 unq 3 iso 0 dist 9.06201 8.96263 9.9943 6.78064 8.60781 9.89345 numMergedOcc 0
22 mol 230 unq 0 iso 0 dist 5.00735 9.32781 4.85368 14.0562 12.5516 9.76875 numMergedOcc 0
23 mol 230 unq 1 iso 0 dist 9.27643 7.66323 4.85368 5.62916 12.5516 9.76875 numMergedOcc 0
24 mol 230 unq 2 iso 0 dist 6.73755 9.32781 7.91665 14.0562 14.4019 9.76875 numMergedOcc 0
25 mol 239 unq 0 iso 0 dist 8.78008 7.80073 8.20191 7.1782 10.4752 6.98781 numMergedOcc 0
26 mol 239 unq 1 iso 0 dist 8.33254 8.92121 11.8831 18.2417 21.3257 9.84931 numMergedOcc 0
27 mol 239 unq 2 iso 0 dist 8.33254 8.92121 11.8831 11.2062 16.4685 5.58605 numMergedOcc 0
28 mol 259 unq 0 iso 0 dist 5.96276 9.78704 7.53628 11.7961 13.252 9.60653 numMergedOcc 0
