0 mol 5 unq 0 iso 0 dist 8.30937 10.0561 8.81964 12.4817 8.49537 3.9731 19.2376 14.7887 12.9534 9.70883 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 8.30937 10.0561 8.81964 12.4817 8.49537 3.9731 15.9159 8.65468 11.4698 9.65565 numMergedOcc 0
2 mol 28 unq 0 iso 0 dist 5.66828 5.81034 8.48456 4.50098 5.42412 5.61871 11.8588 9.64948 8.79638 8.53424 numMergedOcc 0
3 mol 28 unq 1 iso 0 dist 5.66828 5.81034 8.48456 8.14695 8.09862 7.3517 11.8588 9.64948 8.79638 7.08766 numMergedOcc 0
4 mol 28 unq 2 iso 0 dist 5.66828 5.81034 8.48456 9.01546 8.89114 6.13016 11.8588 9.64948 8.79638 4.82199 numMergedOcc 0
5 mol 46 unq 0 iso 0 dist 6.64844 10.0955 7.43338 8.59614 7.44805 8.28528 8.13664 6.81182 10.7521 3.77542 numMergedOcc 0
6 mol 46 unq 1 iso 0 dist 6.64844 10.0955 7.43338 8.59614 7.44805 8.28528 16.6386 16.1056 17.9678 9.97314 numMergedOcc 0
7 mol 76 unq 0 iso 0 dist 9.49371 11.3498 9.26231 15.9372 9.50939 14.6307 17.7798 8.58474 13.1652 7.66068 numMergedOcc 0
8 mol 76 unq 1 iso 0 dist 5.05941 8.10722 9.26231 14.3512 9.50939 14.6307 11.7074 8.58474 13.1652 7.66068 numMergedOcc 0
9 mol 76 unq 2 iso 0 dist 9.66942 5.66928 9.26231 17.8535 9.50939 14.6307 15.5561 8.58474 13.1652 7.66068 numMergedOcc 0
10 mol 79 unq 0 iso 0 dist 9.05293 10.5363 9.8089 10.3999 6.64921 9.57279 10.234 4.15002 11.592 4.15789 numMergedOcc 0
11 mol 79 unq 1 iso 0 dist 9.05293 10.5363 9.8089 10.3999 6.64921 9.57279 12.7549 9.36535 14.3382 4.808 numMergedOcc 0
12 mol 83 unq 0 iso 0 dist 9.55654 12.3414 7.9309 11.7587 5.13041 6.60457 10.9973 4.48523 12.2134 7.50925 numMergedOcc 0
13 mol 101 unq 0 iso 0 dist 8.70947 8.24111 9.60223 9.94084 8.2549 6.741 8.8847 6.43467 12.2095 8.19144 numMergedOcc 0
14 mol 101 unq 1 iso 0 dist 8.70947 5.23253 7.11476 9.94084 8.2549 4.80201 8.8847 6.43467 6.54699 8.19144 numMergedOcc 0
15 mol 225 unq 0 iso 0 dist 8.621 13.2093 7.0412 3.64687 6.35772 9.71885 7.22151 11.0751 16.6732 9.54529 numMergedOcc 0
16 mol 260 unq 0 iso 0 dist 8.67835 6.0591 8.13605 7.91474 4.76164 8.05498 7.22473 9.45061 12.295 8.62655 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 9.53867 14.7732 9.24592 5.28038 5.55176 10.326 9.96328 5.13698 7.29668 4.68668 numMergedOcc 0
18 mol 288 unq 0 iso 0 dist 9.53867 14.7732 9.24592 5.28038 5.55176 10.326 9.96328 5.13698 7.29668 4.68668 numMergedOcc 0
19 mol 289 unq 0 iso 0 dist 9.53867 14.7732 9.24592 5.28038 5.55176 10.326 9.96328 5.13698 7.29668 4.68668 numMergedOcc 0
