0 mol 15 unq 0 iso 0 dist 6.88546 11.1852 6.23015 15.2388 10.1154 8.85174 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 5.36911 5.37568 5.94982 9.04834 6.51133 7.65889 numMergedOcc 0
2 mol 16 unq 1 iso 0 dist 5.36911 5.37568 5.94982 8.17898 5.30082 6.42835 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 8.3964 10.4819 6.61696 12.6611 5.11617 5.68215 numMergedOcc 0
4 mol 24 unq 1 iso 0 dist 8.3964 5.61248 5.80953 12.9306 8.52463 7.95042 numMergedOcc 0
5 mol 24 unq 2 iso 0 dist 7.06532 6.87351 4.5711 5.87895 6.38336 8.87744 numMergedOcc 0
6 mol 24 unq 3 iso 0 dist 7.06532 7.79018 4.44526 5.87895 6.38336 7.27472 numMergedOcc 0
7 mol 25 unq 0 iso 0 dist 8.61491 10.8815 6.29797 14.2542 5.68392 7.6114 numMergedOcc 0
8 mol 48 unq 0 iso 0 dist 6.42242 7.51675 6.07052 5.36645 8.82805 9.17838 numMergedOcc 0
9 mol 73 unq 0 iso 0 dist 6.66506 14.7163 8.96616 10.4766 6.56633 8.68662 numMergedOcc 0
10 mol 73 unq 1 iso 0 dist 6.66506 11.5216 6.14542 5.79954 5.11416 9.73086 numMergedOcc 0
11 mol 73 unq 2 iso 0 dist 6.66506 11.5216 6.14542 10.4766 6.56633 7.4369 numMergedOcc 0
12 mol 119 unq 0 iso 0 dist 6.67326 6.31352 8.67537 9.85387 5.13589 8.95212 numMergedOcc 0
13 mol 119 unq 1 iso 0 dist 6.67326 6.31352 8.67537 11.4157 10.8661 6.99446 numMergedOcc 0
14 mol 119 unq 2 iso 0 dist 6.67326 6.31352 8.67537 13.2459 12.0175 7.64052 numMergedOcc 0
15 mol 134 unq 0 iso 0 dist 7.50264 10.5179 7.83568 13.5646 6.98221 9.10524 numMergedOcc 0
16 mol 134 unq 1 iso 0 dist 7.50264 10.5179 7.83568 13.6135 14.2198 9.00918 numMergedOcc 0
17 mol 162 unq 0 iso 0 dist 6.80226 4.92282 8.33407 9.42819 10.1865 7.45998 numMergedOcc 0
18 mol 204 unq 0 iso 0 dist 8.82861 5.99091 9.48625 7.7292 5.86489 7.9133 numMergedOcc 0
19 mol 232 unq 0 iso 0 dist 8.27761 13.0806 9.9183 10.8093 4.9377 6.71524 numMergedOcc 0
20 mol 239 unq 0 iso 0 dist 6.91534 3.28983 8.95511 9.27989 11.169 6.73665 numMergedOcc 0
21 mol 239 unq 1 iso 0 dist 6.91534 3.28983 8.95511 12.015 18.2672 9.34438 numMergedOcc 0
22 mol 239 unq 2 iso 0 dist 6.91534 3.28983 8.95511 11.3081 13.9678 9.35949 numMergedOcc 0
23 mol 250 unq 0 iso 0 dist 8.85979 5.16962 9.30531 8.21206 4.34713 6.59244 numMergedOcc 0
24 mol 279 unq 0 iso 0 dist 9.29922 4.91802 7.17958 6.47376 12.6502 6.35028 numMergedOcc 0
