0 mol 7 unq 0 iso 0 dist 6.22805 5.99355 5.72491 13.3926 12.2041 7.88043 15.2825 10.5461 10.2446 8.41585 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 7.84393 4.93362 6.36455 10.1953 5.03957 6.92532 15.6111 12.1187 12.3486 7.20519 numMergedOcc 0
2 mol 19 unq 1 iso 0 dist 7.84393 4.93362 6.36455 10.1953 5.03957 6.92532 9.01721 7.82074 5.18512 4.54938 numMergedOcc 0
3 mol 19 unq 2 iso 0 dist 7.84393 4.93362 6.36455 10.1953 5.03957 6.92532 14.1708 11.0366 9.47529 6.864 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 6.35095 6.80952 4.93188 12.4687 12.3067 9.24958 5.76725 5.54419 4.33963 7.36323 numMergedOcc 0
5 mol 24 unq 1 iso 0 dist 5.87895 9.6739 9.24958 11.0381 12.3067 4.93188 5.75653 7.36323 4.33963 5.54419 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 6.30194 14.8714 8.73253 10.392 5.4148 7.04044 10.5627 6.19304 8.26458 9.96396 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 6.30194 14.8714 8.73253 10.392 5.4148 7.04044 17.4113 11.6369 8.35241 9.75218 numMergedOcc 0
8 mol 73 unq 2 iso 0 dist 6.30194 14.8714 8.73253 10.392 5.4148 7.04044 10.8067 10.2049 15.7304 9.38498 numMergedOcc 0
9 mol 73 unq 3 iso 0 dist 5.79954 5.67493 7.04044 10.4766 5.4148 8.73253 12.8388 9.96396 8.26458 6.19304 numMergedOcc 0
10 mol 73 unq 4 iso 0 dist 7.01889 11.2215 7.04044 10.997 5.4148 8.73253 15.0744 9.96396 8.26458 6.19304 numMergedOcc 0
11 mol 109 unq 0 iso 0 dist 8.39771 14.6851 7.55384 12.9387 4.98336 5.34214 20.4735 13.4572 9.14441 8.69985 numMergedOcc 0
12 mol 112 unq 0 iso 0 dist 8.35164 5.51584 6.78038 9.43616 4.8896 6.47042 10.746 11.5121 10.0814 7.71338 numMergedOcc 0
13 mol 181 unq 0 iso 0 dist 9.07833 4.97043 7.20392 11.44 10.1912 6.51749 18.2553 15.0228 13.8722 9.1374 numMergedOcc 0
14 mol 181 unq 1 iso 0 dist 9.07833 4.97043 7.20392 11.44 10.1912 6.51749 9.54619 9.09537 5.93488 5.98885 numMergedOcc 0
15 mol 181 unq 2 iso 0 dist 9.07833 4.97043 7.20392 11.44 10.1912 6.51749 9.33514 12.9862 7.64267 9.15386 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 7.45401 8.19136 7.20574 11.5381 5.74635 6.85302 6.8549 7.54065 8.90184 8.87694 numMergedOcc 0
17 mol 186 unq 1 iso 0 dist 7.45401 8.19136 7.20574 11.5381 5.74635 6.85302 10.3403 10.7914 4.37002 9.09754 numMergedOcc 0
18 mol 186 unq 2 iso 0 dist 6.86297 8.88762 6.85302 10.7452 5.74635 7.20574 8.03427 8.87694 8.90184 7.54065 numMergedOcc 0
19 mol 214 unq 0 iso 0 dist 7.77535 4.08418 7.05523 11.9696 12.7897 8.46327 11.3575 16.7691 10.2399 8.82096 numMergedOcc 0
20 mol 229 unq 0 iso 0 dist 8.0007 7.57247 5.77318 12.776 7.0298 8.92743 12.1346 11.7165 11.6847 8.22528 numMergedOcc 0
21 mol 229 unq 1 iso 0 dist 8.0007 7.57247 5.77318 12.776 7.0298 8.92743 13.3828 11.4362 9.62106 7.03423 numMergedOcc 0
22 mol 229 unq 2 iso 0 dist 9.92027 5.77507 8.19603 12.4161 15.7694 8.92743 14.8327 19.5385 11.6847 8.22528 numMergedOcc 0
23 mol 229 unq 3 iso 0 dist 9.92027 5.77507 8.19603 12.4161 15.7694 8.92743 10.8972 17.78 9.62106 7.03423 numMergedOcc 0
24 mol 229 unq 4 iso 0 dist 9.92027 5.77507 8.19603 11.1915 9.96077 5.77318 11.2794 13.8823 7.7339 9.87838 numMergedOcc 0
25 mol 248 unq 0 iso 0 dist 6.44967 4.01898 6.17052 11.4848 5.55137 9.77666 9.48478 7.69895 5.99459 7.21521 numMergedOcc 0
26 mol 258 unq 0 iso 0 dist 7.9357 11.517 7.99477 13.7159 7.26417 6.70815 8.73372 6.42289 7.42673 6.60405 numMergedOcc 0
27 mol 258 unq 1 iso 0 dist 8.81059 15.4617 7.99477 14.0712 7.26417 6.70815 9.78068 6.42289 7.42673 6.60405 numMergedOcc 0
28 mol 258 unq 2 iso 0 dist 9.47519 7.38682 7.93574 11.9494 5.30627 7.86627 13.2295 10.1675 6.44209 6.42289 numMergedOcc 0
29 mol 258 unq 3 iso 0 dist 5.79537 5.04382 7.93574 7.9357 5.30627 7.86627 8.73372 10.1675 6.44209 6.42289 numMergedOcc 0
30 mol 258 unq 4 iso 0 dist 9.12006 11.0527 7.93574 8.81059 5.30627 7.86627 9.78068 10.1675 6.44209 6.42289 numMergedOcc 0
31 mol 261 unq 0 iso 0 dist 8.50313 11.2562 8.60026 11.3146 7.00201 5.26434 13.3163 8.45658 6.04016 9.14619 numMergedOcc 0
32 mol 261 unq 1 iso 0 dist 7.6414 13.4429 8.60026 13.063 7.00201 5.26434 13.6041 8.45658 6.04016 9.14619 numMergedOcc 0
