0 mol 24 unq 0 iso 0 dist 9.54519 13.2653 5.54419 12.1061 8.4051 5.11617 8.6586 6.7846 8.23075 7.85986 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 9.54519 13.2653 5.54419 12.1061 8.4051 5.11617 13.2236 8.03955 4.7841 4.30252 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 9.54519 5.80023 7.36323 12.1061 8.4051 13.2229 8.6586 6.7846 10.551 7.85986 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 9.54519 5.80023 7.36323 12.1061 8.4051 13.2229 13.2236 8.03955 14.1707 4.30252 numMergedOcc 0
4 mol 24 unq 4 iso 0 dist 6.11056 10.4744 8.86116 11.095 8.60554 8.52463 15.4692 13.2846 16.3188 7.85986 numMergedOcc 0
5 mol 24 unq 5 iso 0 dist 6.11056 10.4744 8.86116 11.095 8.60554 8.52463 15.1745 12.3897 12.0986 4.30252 numMergedOcc 0
6 mol 24 unq 6 iso 0 dist 6.11056 6.9756 8.38394 11.095 8.60554 12.3994 15.4692 13.2846 19.2143 7.85986 numMergedOcc 0
7 mol 24 unq 7 iso 0 dist 6.11056 6.9756 8.38394 11.095 8.60554 12.3994 15.1745 12.3897 16.6275 4.30252 numMergedOcc 0
8 mol 61 unq 0 iso 0 dist 9.22002 6.16737 6.65721 12.7481 9.25641 13.5488 17.9568 9.57611 15.0824 9.83914 numMergedOcc 0
9 mol 101 unq 0 iso 0 dist 5.22543 4.50603 6.57035 5.08458 6.98314 5.53055 6.67863 6.2696 10.7342 9.44645 numMergedOcc 0
10 mol 113 unq 0 iso 0 dist 8.89481 4.36935 5.86073 11.2266 8.8822 10.1816 14.8951 15.3211 14.4591 7.40338 numMergedOcc 0
11 mol 113 unq 1 iso 0 dist 8.89481 4.36935 5.86073 9.01097 9.66219 8.42718 9.86767 13.0914 9.59585 5.35711 numMergedOcc 0
12 mol 113 unq 2 iso 0 dist 8.89481 4.36935 5.86073 9.01097 9.66219 8.42718 14.8951 15.3211 14.4591 6.23759 numMergedOcc 0
13 mol 129 unq 0 iso 0 dist 6.38163 8.61575 9.61051 7.03404 6.28565 6.30169 7.04904 10.3933 13.1959 8.98175 numMergedOcc 0
14 mol 129 unq 1 iso 0 dist 6.38163 10.0961 5.83384 7.03404 6.28565 4.55551 7.04904 10.3933 12.0878 8.98175 numMergedOcc 0
15 mol 205 unq 0 iso 0 dist 5.96555 4.6995 6.03031 3.99238 6.03688 8.15057 8.86316 6.49049 11.5794 5.59832 numMergedOcc 0
16 mol 205 unq 1 iso 0 dist 5.96555 10.7091 7.26832 3.99238 6.03688 12.4957 8.86316 6.49049 13.4668 5.59832 numMergedOcc 0
17 mol 205 unq 2 iso 0 dist 5.96555 5.87892 7.80463 3.99238 6.03688 6.09749 8.86316 6.49049 8.26637 5.59832 numMergedOcc 0
18 mol 206 unq 0 iso 0 dist 9.36079 13.6173 7.7366 10.9922 6.16414 6.45859 11.8579 4.46135 11.1153 7.9416 numMergedOcc 0
19 mol 206 unq 1 iso 0 dist 7.42904 9.96254 7.7366 8.16827 6.16414 6.45859 10.9003 4.46135 11.1153 7.9416 numMergedOcc 0
20 mol 232 unq 0 iso 0 dist 9.29752 9.60401 8.27212 6.36084 9.40808 4.9377 11.6863 4.04428 8.25985 9.78273 numMergedOcc 0
21 mol 241 unq 0 iso 0 dist 9.10633 7.20238 7.4631 4.85571 7.89524 4.45049 8.49869 4.07839 10.0267 8.73192 numMergedOcc 0
22 mol 249 unq 0 iso 0 dist 6.37672 9.07501 7.57994 4.20164 5.48118 10.7772 12.1989 10.3504 14.0808 8.76518 numMergedOcc 0
23 mol 249 unq 1 iso 0 dist 6.37672 4.24014 6.18582 4.20164 5.48118 7.04666 12.1989 10.3504 12.9043 8.76518 numMergedOcc 0
24 mol 249 unq 2 iso 0 dist 8.94023 9.53929 7.57994 5.93404 5.48118 10.7772 11.121 10.3504 14.0808 8.76518 numMergedOcc 0
25 mol 249 unq 3 iso 0 dist 8.94023 5.36989 6.18582 5.93404 5.48118 7.04666 11.121 10.3504 12.9043 8.76518 numMergedOcc 0
26 mol 274 unq 0 iso 0 dist 9.71801 5.9882 7.56915 4.36131 8.52587 5.29529 12.3011 12.5154 11.8311 8.09181 numMergedOcc 0
27 mol 292 unq 0 iso 0 dist 9.20416 5.26243 8.2734 11.6878 7.07965 10.8848 15.2035 7.22011 13.0682 5.91617 numMergedOcc 0
28 mol 292 unq 1 iso 0 dist 7.53641 5.58251 8.2734 8.46139 7.07965 10.8848 9.01115 7.22011 13.0682 5.91617 numMergedOcc 0
