0 mol 0 unq 0 iso 0 dist 6.80636 9.15248 8.31596 13.3498 8.8123 6.3267 10.4388 4.62412 7.92928 5.96303 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 6.80636 9.15248 8.31596 13.3498 8.8123 6.3267 16.0765 12.5081 7.48645 4.04089 numMergedOcc 0
2 mol 0 unq 2 iso 0 dist 9.23213 10.3034 6.3267 15.944 8.8123 8.31596 12.412 5.96303 7.92928 4.62412 numMergedOcc 0
3 mol 0 unq 3 iso 0 dist 9.23213 10.3034 6.3267 15.944 8.8123 8.31596 6.26831 4.04089 7.48645 12.5081 numMergedOcc 0
4 mol 9 unq 0 iso 0 dist 8.47421 11.4878 7.2199 12.6047 6.27573 6.9513 8.83269 6.81435 9.82483 12.6271 numMergedOcc 0
5 mol 9 unq 1 iso 0 dist 8.47421 11.4878 7.2199 14.9473 11.1737 9.16116 8.83269 6.81435 9.82483 17.0455 numMergedOcc 0
6 mol 9 unq 2 iso 0 dist 8.47421 11.4878 7.2199 16.8226 10.9842 8.47109 8.83269 6.81435 9.82483 10.0146 numMergedOcc 0
7 mol 9 unq 3 iso 0 dist 6.85412 5.60154 9.29529 6.33889 5.80437 7.2199 9.78006 7.98363 8.04924 10.4204 numMergedOcc 0
8 mol 9 unq 4 iso 0 dist 6.33889 5.60154 7.2199 6.85412 5.80437 9.29529 9.78006 10.4204 8.04924 7.98363 numMergedOcc 0
9 mol 58 unq 0 iso 0 dist 9.58673 6.47744 7.01363 12.4575 6.49184 6.96494 10.5365 6.11542 7.93481 5.60902 numMergedOcc 0
10 mol 94 unq 0 iso 0 dist 8.3586 10.0455 7.38914 12.6451 5.31202 7.0529 18.7749 15.7837 9.13207 13.286 numMergedOcc 0
11 mol 94 unq 1 iso 0 dist 8.3586 10.0455 7.38914 12.6451 5.31202 7.0529 10.5455 5.64735 5.18655 6.93872 numMergedOcc 0
12 mol 114 unq 0 iso 0 dist 6.73814 12.1324 9.86739 17.4431 12.0339 9.49413 14.3116 8.36453 8.06525 6.18257 numMergedOcc 0
13 mol 218 unq 0 iso 0 dist 8.53199 7.47048 6.75035 10.9531 8.16398 8.57853 8.06216 5.31559 9.67381 7.02365 numMergedOcc 0
14 mol 218 unq 1 iso 0 dist 8.53199 7.47048 6.75035 10.9531 8.16398 8.57853 5.76954 8.21424 6.61099 5.84583 numMergedOcc 0
15 mol 225 unq 0 iso 0 dist 5.50387 10.7506 8.75834 17.6316 14.0478 7.51827 11.5332 7.15437 5.13453 7.13893 numMergedOcc 0
16 mol 225 unq 1 iso 0 dist 5.50387 10.7506 8.75834 17.6316 14.0478 7.51827 15.6311 15.2958 7.95883 10.4901 numMergedOcc 0
17 mol 227 unq 0 iso 0 dist 9.62609 8.8709 6.152 6.95902 8.55671 7.95168 5.4694 5.23507 7.89801 5.92529 numMergedOcc 0
18 mol 227 unq 1 iso 0 dist 8.17891 13.3557 7.95168 13.4493 8.55671 6.152 8.38865 5.92529 7.89801 5.23507 numMergedOcc 0
19 mol 227 unq 2 iso 0 dist 6.95902 8.8709 7.95168 9.62609 8.55671 6.152 5.4694 5.92529 7.89801 5.23507 numMergedOcc 0
20 mol 234 unq 0 iso 0 dist 9.5707 12.1076 9.6101 10.475 9.35875 5.32183 13.7892 9.66782 9.06084 5.3976 numMergedOcc 0
21 mol 234 unq 1 iso 0 dist 9.39181 6.29366 5.32183 11.8897 9.35875 9.6101 14.2988 5.3976 9.06084 9.66782 numMergedOcc 0
22 mol 250 unq 0 iso 0 dist 8.80086 7.26274 9.88279 11.0437 6.59053 8.16469 13.1352 13.3093 9.03319 7.62569 numMergedOcc 0
