0 mol 69 unq 0 iso 0 dist 8.44753 8.09271 7.3232 5.07575 5.06756 9.23947 numMergedOcc 0
1 mol 133 unq 0 iso 0 dist 9.89671 9.13917 5.25819 11.0718 14.1348 9.56319 numMergedOcc 0
2 mol 133 unq 1 iso 0 dist 9.89671 9.13917 5.25819 17.2439 14.379 9.73038 numMergedOcc 0
3 mol 133 unq 2 iso 0 dist 4.46578 6.53862 8.13581 4.77272 8.61448 5.84909 numMergedOcc 0
4 mol 148 unq 0 iso 0 dist 5.86949 8.91834 11.7686 3.9163 9.7788 9.00881 numMergedOcc 0
5 mol 150 unq 0 iso 0 dist 5.84971 8.84061 11.6581 3.9243 9.75445 9.03478 numMergedOcc 0
6 mol 167 unq 0 iso 0 dist 6.5782 5.32056 4.49322 9.2968 13.4022 9.63473 numMergedOcc 0
7 mol 167 unq 1 iso 0 dist 6.5782 5.32056 4.49322 5.79787 9.65404 8.39087 numMergedOcc 0
8 mol 168 unq 0 iso 0 dist 9.88342 9.01437 8.66083 10.8619 13.0453 5.60956 numMergedOcc 0
9 mol 168 unq 1 iso 0 dist 9.58783 9.6856 17.0492 12.8199 18.4379 5.60956 numMergedOcc 0
10 mol 184 unq 0 iso 0 dist 9.0757 7.73442 15.8237 7.11382 15.2986 9.34265 numMergedOcc 0
11 mol 233 unq 0 iso 0 dist 7.5099 6.58227 4.40152 4.69692 11.8021 9.72186 numMergedOcc 0
12 mol 233 unq 1 iso 0 dist 7.5099 6.58227 4.40152 5.49245 6.87565 8.39315 numMergedOcc 0
13 mol 238 unq 0 iso 0 dist 7.00773 6.9659 4.91848 5.22428 8.93135 7.12027 numMergedOcc 0
14 mol 247 unq 0 iso 0 dist 6.56182 8.0367 10.3845 15.733 15.8157 9.21409 numMergedOcc 0
15 mol 247 unq 1 iso 0 dist 6.56182 8.0367 10.3845 17.1904 18.6368 9.17812 numMergedOcc 0
16 mol 247 unq 2 iso 0 dist 5.32075 8.0367 6.75612 15.733 14.8402 9.21409 numMergedOcc 0
17 mol 247 unq 3 iso 0 dist 5.32075 8.0367 6.75612 17.1904 14.7401 9.17812 numMergedOcc 0
18 mol 279 unq 0 iso 0 dist 9.71938 8.12646 4.27883 6.83789 11.0863 9.16172 numMergedOcc 0
19 mol 293 unq 0 iso 0 dist 6.02106 8.84911 5.48105 4.35498 7.67909 8.04021 numMergedOcc 0
20 mol 293 unq 1 iso 0 dist 8.27274 8.84911 4.88851 4.35498 6.83404 8.04021 numMergedOcc 0
