0 mol 48 unq 0 iso 0 dist 5.78969 5.68596 8.29857 7.90364 6.17529 6.28603 numMergedOcc 0
1 mol 48 unq 1 iso 0 dist 5.78969 5.68596 8.29857 11.6061 9.78584 8.80303 numMergedOcc 0
2 mol 48 unq 2 iso 0 dist 5.78969 5.68596 8.29857 11.8549 11.505 7.11491 numMergedOcc 0
3 mol 48 unq 3 iso 0 dist 5.7898 5.69576 8.19993 7.78518 6.30002 5.73454 numMergedOcc 0
4 mol 48 unq 4 iso 0 dist 5.7898 5.69576 8.19993 11.3308 9.72383 8.2012 numMergedOcc 0
5 mol 48 unq 5 iso 0 dist 5.7898 5.69576 8.19993 11.8714 11.5388 7.1829 numMergedOcc 0
6 mol 54 unq 0 iso 0 dist 6.32568 8.89627 9.17082 6.89022 10.1455 8.75957 numMergedOcc 0
7 mol 91 unq 0 iso 0 dist 9.44289 11.0296 8.66165 10.6103 5.21888 9.97813 numMergedOcc 0
8 mol 116 unq 0 iso 0 dist 9.28045 9.60499 8.38606 10.5377 4.13755 8.58308 numMergedOcc 0
9 mol 131 unq 0 iso 0 dist 9.66687 5.06665 5.87084 9.8911 4.60864 7.84546 numMergedOcc 0
10 mol 131 unq 1 iso 0 dist 9.68242 7.7998 5.87084 7.02043 4.60864 7.84546 numMergedOcc 0
11 mol 141 unq 0 iso 0 dist 7.90709 8.90481 9.83945 8.56285 3.80087 9.59109 numMergedOcc 0
12 mol 141 unq 1 iso 0 dist 9.03842 8.90481 6.75376 8.56285 3.80763 9.59109 numMergedOcc 0
13 mol 184 unq 0 iso 0 dist 9.02161 5.9935 7.54099 8.93083 4.12242 7.02762 numMergedOcc 0
14 mol 184 unq 1 iso 0 dist 8.38137 8.11291 7.54099 5.62851 4.12242 7.02762 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 7.89312 9.52106 6.21159 11.8218 5.39534 5.25762 numMergedOcc 0
16 mol 232 unq 0 iso 0 dist 6.02641 6.25229 9.8664 13.2065 12.159 9.78273 numMergedOcc 0
17 mol 237 unq 0 iso 0 dist 7.3216 5.31202 8.10254 9.75715 5.18809 8.95332 numMergedOcc 0
18 mol 277 unq 0 iso 0 dist 9.04531 6.17749 8.20644 11.2469 12.1127 6.23115 numMergedOcc 0
19 mol 280 unq 0 iso 0 dist 8.83569 4.71431 6.73712 10.4457 8.71368 9.47429 numMergedOcc 0
