0 mol 28 unq 0 iso 0 dist 7.56095 13.4544 9.20625 10.4466 4.23443 8.92334 numMergedOcc 0
1 mol 28 unq 1 iso 0 dist 8.9136 7.99283 8.33169 16.2039 11.0902 8.97167 numMergedOcc 0
2 mol 28 unq 2 iso 0 dist 8.9136 7.99283 8.33169 14.9963 8.59089 8.8182 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 9.14324 10.6411 8.90701 8.93792 4.2509 6.57978 numMergedOcc 0
4 mol 68 unq 0 iso 0 dist 5.13951 9.47129 7.89895 9.44912 6.36692 8.34115 numMergedOcc 0
5 mol 68 unq 1 iso 0 dist 5.88852 9.47129 9.54996 9.44912 4.44938 8.34115 numMergedOcc 0
6 mol 120 unq 0 iso 0 dist 5.94417 9.18392 6.14769 7.78914 3.3085 9.13689 numMergedOcc 0
7 mol 120 unq 1 iso 0 dist 7.48283 9.18392 8.02616 7.78914 8.27043 9.13689 numMergedOcc 0
8 mol 142 unq 0 iso 0 dist 6.00045 7.46089 8.20354 5.79144 3.06927 6.81144 numMergedOcc 0
9 mol 154 unq 0 iso 0 dist 9.58365 11.7272 9.2828 19.2064 17.5486 8.76245 numMergedOcc 0
10 mol 165 unq 0 iso 0 dist 6.78432 12.7545 8.01191 19.5907 13.1897 9.54118 numMergedOcc 0
11 mol 176 unq 0 iso 0 dist 8.69001 6.06965 5.61752 13.7673 10.3887 9.40138 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 5.94087 6.98632 4.95355 6.92364 3.52454 8.15495 numMergedOcc 0
13 mol 230 unq 0 iso 0 dist 9.48167 6.0031 7.668 9.35071 3.83847 5.48736 numMergedOcc 0
14 mol 230 unq 1 iso 0 dist 9.2573 9.16661 7.668 10.9793 3.83847 5.48736 numMergedOcc 0
15 mol 239 unq 0 iso 0 dist 5.55434 6.78632 7.87797 7.01673 5.98994 4.44509 numMergedOcc 0
16 mol 239 unq 1 iso 0 dist 6.71734 5.94643 9.90442 11.1939 14.8218 5.4687 numMergedOcc 0
17 mol 260 unq 0 iso 0 dist 7.71093 5.67613 7.8339 7.30584 5.99357 4.76164 numMergedOcc 0
18 mol 268 unq 0 iso 0 dist 9.73322 6.41127 8.38444 7.04565 3.80726 5.49906 numMergedOcc 0
