0 mol 0 unq 0 iso 0 dist 9.94618 5.52842 5.99946 7.49611 12.4363 7.46173 numMergedOcc 0
1 mol 66 unq 0 iso 0 dist 9.31938 8.80205 5.36057 6.90892 9.37957 6.49416 numMergedOcc 0
2 mol 111 unq 0 iso 0 dist 8.41868 9.48248 4.6984 6.47972 10.352 8.51098 numMergedOcc 0
3 mol 185 unq 0 iso 0 dist 6.11382 7.31121 3.80778 10.9948 8.04591 9.85424 numMergedOcc 0
4 mol 194 unq 0 iso 0 dist 5.69866 8.28887 11.3108 4.78204 10.4489 7.61316 numMergedOcc 0
5 mol 213 unq 0 iso 0 dist 8.84278 6.21228 4.96362 8.28789 4.58599 7.2016 numMergedOcc 0
6 mol 222 unq 0 iso 0 dist 9.5045 8.47669 15.1201 9.95325 17.1404 6.83371 numMergedOcc 0
7 mol 224 unq 0 iso 0 dist 8.66222 9.62024 12.8174 7.45633 15.7696 9.92067 numMergedOcc 0
8 mol 224 unq 1 iso 0 dist 8.66222 9.62024 12.8174 10.7114 17.7724 7.7904 numMergedOcc 0
9 mol 274 unq 0 iso 0 dist 9.30966 5.40969 9.12219 11.1036 13.6339 8.73167 numMergedOcc 0
10 mol 274 unq 1 iso 0 dist 5.38704 5.40969 7.49685 11.1036 10.3428 8.73167 numMergedOcc 0
11 mol 274 unq 2 iso 0 dist 8.05503 5.40969 12.1845 11.1036 12.9668 8.73167 numMergedOcc 0
12 mol 274 unq 3 iso 0 dist 7.24089 8.07071 15.2786 5.79262 11.5132 6.0868 numMergedOcc 0
13 mol 274 unq 4 iso 0 dist 7.24089 4.52484 11.4975 5.56999 6.00877 8.11169 numMergedOcc 0
14 mol 274 unq 5 iso 0 dist 7.24089 4.52484 11.4975 5.79262 11.5132 6.32856 numMergedOcc 0
15 mol 274 unq 6 iso 0 dist 9.96645 8.55229 10.5972 6.04536 9.696 6.92434 numMergedOcc 0
16 mol 274 unq 7 iso 0 dist 9.29005 8.55229 14.2631 6.04536 11.5132 6.92434 numMergedOcc 0
17 mol 274 unq 8 iso 0 dist 8.16746 8.55229 12.4552 6.04536 12.0331 6.92434 numMergedOcc 0
18 mol 274 unq 9 iso 0 dist 9.2447 5.66614 7.01676 6.12463 9.696 6.93875 numMergedOcc 0
19 mol 274 unq 10 iso 0 dist 9.2447 6.26101 12.2416 6.12463 9.696 6.0868 numMergedOcc 0
20 mol 274 unq 11 iso 0 dist 9.2447 7.81271 15.0971 13.1422 18.4193 8.11169 numMergedOcc 0
21 mol 274 unq 12 iso 0 dist 9.2447 7.81271 15.0971 6.12463 9.696 6.32856 numMergedOcc 0
22 mol 274 unq 13 iso 0 dist 7.87268 5.66614 6.13201 6.12463 11.6937 6.93875 numMergedOcc 0
23 mol 274 unq 14 iso 0 dist 7.87268 6.26101 7.44098 6.12463 11.6937 6.0868 numMergedOcc 0
24 mol 274 unq 15 iso 0 dist 7.87268 7.81271 11.5425 13.1422 19.0796 8.11169 numMergedOcc 0
25 mol 274 unq 16 iso 0 dist 7.87268 7.81271 11.5425 6.12463 11.6937 6.32856 numMergedOcc 0
26 mol 279 unq 0 iso 0 dist 9.51355 9.4028 17.0172 8.44634 17.8808 6.55783 numMergedOcc 0
27 mol 279 unq 1 iso 0 dist 8.31465 9.4028 7.37601 8.44634 11.9297 6.55783 numMergedOcc 0
28 mol 279 unq 2 iso 0 dist 7.88102 6.30145 7.37601 10.4647 11.9297 6.55783 numMergedOcc 0
29 mol 279 unq 3 iso 0 dist 7.93694 6.30145 6.14371 10.4647 12.3897 6.55783 numMergedOcc 0
