0 mol 1 unq 0 iso 0 dist 6.41817 7.42008 9.76602 11.6758 7.46399 9.77112 7.49891 7.83632 9.84669 9.72712 numMergedOcc 0
1 mol 27 unq 0 iso 0 dist 5.80623 5.21735 5.66743 8.21453 7.18409 3.9551 10.1283 7.60283 11.6846 14.335 numMergedOcc 0
2 mol 27 unq 1 iso 0 dist 5.80623 5.21735 5.66743 6.8422 6.21163 5.10645 10.1283 7.60283 11.6846 8.38749 numMergedOcc 0
3 mol 27 unq 2 iso 0 dist 5.80623 4.66619 7.42669 8.21453 7.18409 10.978 10.1283 7.60283 8.05284 14.335 numMergedOcc 0
4 mol 27 unq 3 iso 0 dist 5.80623 4.66619 7.42669 6.8422 6.21163 5.00553 10.1283 7.60283 8.05284 8.38749 numMergedOcc 0
5 mol 27 unq 4 iso 0 dist 7.24775 12.4614 5.66743 14.1996 7.18409 3.9551 3.71754 7.60283 11.6846 14.335 numMergedOcc 0
6 mol 27 unq 5 iso 0 dist 7.24775 12.4614 5.66743 10.2292 6.21163 5.10645 3.71754 7.60283 11.6846 8.38749 numMergedOcc 0
7 mol 27 unq 6 iso 0 dist 7.24775 10.6589 7.42669 14.1996 7.18409 10.978 3.71754 7.60283 8.05284 14.335 numMergedOcc 0
8 mol 27 unq 7 iso 0 dist 7.24775 10.6589 7.42669 10.2292 6.21163 5.00553 3.71754 7.60283 8.05284 8.38749 numMergedOcc 0
9 mol 54 unq 0 iso 0 dist 5.0478 8.88887 4.38047 10.6593 5.7405 4.94741 5.59128 6.30987 8.98505 10.352 numMergedOcc 0
10 mol 56 unq 0 iso 0 dist 7.52378 8.48311 8.85981 11.0121 9.78973 6.07317 6.48665 5.84875 4.62903 4.86374 numMergedOcc 0
11 mol 100 unq 0 iso 0 dist 8.22984 14.6602 9.16592 11.2351 9.95103 14.9354 12.1174 7.09065 7.62048 7.59628 numMergedOcc 0
12 mol 100 unq 1 iso 0 dist 6.6157 10.6262 9.16592 8.46662 9.95103 14.9354 7.39527 7.09065 7.62048 7.59628 numMergedOcc 0
13 mol 100 unq 2 iso 0 dist 7.37771 6.15808 9.16592 10.5049 9.95103 14.9354 5.22124 7.09065 7.62048 7.59628 numMergedOcc 0
14 mol 116 unq 0 iso 0 dist 7.85045 12.6384 7.6005 9.09348 6.63731 5.17486 4.98814 7.35992 8.76048 5.47265 numMergedOcc 0
15 mol 116 unq 1 iso 0 dist 7.85045 12.6384 7.6005 9.09348 6.63731 5.17486 9.53721 6.49383 5.79458 7.15601 numMergedOcc 0
16 mol 116 unq 2 iso 0 dist 7.85045 14.5749 8.7583 9.09348 6.63731 6.28627 4.98814 7.35992 11.4263 5.47265 numMergedOcc 0
17 mol 116 unq 3 iso 0 dist 7.85045 14.5749 8.7583 9.09348 6.63731 6.28627 9.53721 6.49383 9.91115 7.15601 numMergedOcc 0
18 mol 167 unq 0 iso 0 dist 7.93807 10.33 9.14629 10.8805 9.69399 7.8548 6.77802 7.80054 4.0737 6.28495 numMergedOcc 0
19 mol 253 unq 0 iso 0 dist 7.06589 4.58695 9.69704 14.3975 9.6479 17.557 10.6548 9.58354 8.75798 15.4561 numMergedOcc 0
20 mol 253 unq 1 iso 0 dist 8.70383 11.088 9.69704 12.7693 9.6479 17.557 3.494 9.58354 8.75798 15.4561 numMergedOcc 0
21 mol 287 unq 0 iso 0 dist 9.52718 7.88871 7.76945 15.6724 8.9316 9.43452 9.81184 5.59555 4.26276 5.89971 numMergedOcc 0
22 mol 288 unq 0 iso 0 dist 9.52718 7.88871 7.76945 15.6724 8.9316 9.43452 9.81184 5.59555 4.26276 5.89971 numMergedOcc 0
23 mol 289 unq 0 iso 0 dist 9.52718 7.88871 7.76945 15.6724 8.9316 9.43452 9.81184 5.59555 4.26276 5.89971 numMergedOcc 0
