0 mol 15 unq 0 iso 0 dist 6.88546 5.68079 5.69755 11.4251 11.7741 9.62922 numMergedOcc 0
1 mol 37 unq 0 iso 0 dist 8.37816 4.07334 5.48483 11.5018 10.8942 8.5893 numMergedOcc 0
2 mol 37 unq 1 iso 0 dist 8.37816 4.07334 5.48483 7.04664 11.2002 8.22608 numMergedOcc 0
3 mol 79 unq 0 iso 0 dist 9.22889 7.75543 6.0298 6.67981 12.3642 7.60619 numMergedOcc 0
4 mol 91 unq 0 iso 0 dist 6.93893 8.91998 12.8723 15.03 18.3177 9.67751 numMergedOcc 0
5 mol 124 unq 0 iso 0 dist 9.18949 8.50362 9.91987 9.2094 16.8959 9.66083 numMergedOcc 0
6 mol 186 unq 0 iso 0 dist 9.2802 7.90621 3.74763 4.70071 7.59836 7.93563 numMergedOcc 0
7 mol 186 unq 1 iso 0 dist 9.2802 8.0943 4.4787 4.70071 7.59836 5.70056 numMergedOcc 0
8 mol 186 unq 2 iso 0 dist 7.2843 7.90621 4.87674 4.70071 9.94274 7.93563 numMergedOcc 0
9 mol 186 unq 3 iso 0 dist 7.2843 8.0943 8.72129 4.70071 9.94274 5.70056 numMergedOcc 0
10 mol 194 unq 0 iso 0 dist 8.09776 7.56217 12.7379 11.9085 18.8496 7.26295 numMergedOcc 0
11 mol 194 unq 1 iso 0 dist 8.09776 9.81055 15.4151 11.9085 18.8496 7.31316 numMergedOcc 0
12 mol 194 unq 2 iso 0 dist 8.09776 9.81055 15.4151 13.7794 17.503 8.9865 numMergedOcc 0
13 mol 194 unq 3 iso 0 dist 5.4455 7.56217 3.7326 11.9085 9.819 7.26295 numMergedOcc 0
14 mol 194 unq 4 iso 0 dist 5.4455 9.81055 7.29209 11.9085 9.819 7.31316 numMergedOcc 0
15 mol 194 unq 5 iso 0 dist 5.4455 9.81055 7.29209 13.7794 13.6378 8.9865 numMergedOcc 0
16 mol 233 unq 0 iso 0 dist 9.83883 8.2484 5.24709 5.33647 8.76329 5.22629 numMergedOcc 0
17 mol 239 unq 0 iso 0 dist 8.89981 5.19729 8.82573 7.88007 13.4391 9.29322 numMergedOcc 0
18 mol 252 unq 0 iso 0 dist 7.60896 9.09279 10.3958 15.5066 17.732 7.38867 numMergedOcc 0
19 mol 254 unq 0 iso 0 dist 7.00841 5.83039 4.4384 8.48478 12.5377 8.87934 numMergedOcc 0
20 mol 254 unq 1 iso 0 dist 7.00841 5.83039 4.4384 9.66767 13.2437 9.47133 numMergedOcc 0
21 mol 254 unq 2 iso 0 dist 7.00841 6.74364 6.09569 8.48478 12.5377 9.66687 numMergedOcc 0
22 mol 254 unq 3 iso 0 dist 7.00841 6.74364 6.09569 9.66767 13.2437 7.61537 numMergedOcc 0
