0 mol 16 unq 0 iso 0 dist 8.59049 6.21616 6.86055 5.70228 4.7319 7.65889 5.11248 6.72833 5.94982 6.51133 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 8.20058 8.45916 4.79736 16.6906 8.86116 12.3058 11.9824 8.44664 9.98592 10.971 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 8.20058 8.45916 4.79736 14.9411 8.38394 10.6772 11.9824 8.44664 9.98592 5.30734 numMergedOcc 0
3 mol 25 unq 0 iso 0 dist 9.22151 9.95169 5.18617 4.96681 7.57578 9.48085 6.63966 8.50222 6.53269 6.08585 numMergedOcc 0
4 mol 25 unq 1 iso 0 dist 9.22151 9.95169 5.18617 4.96681 7.57578 9.48085 7.66414 12.4659 9.81524 9.15781 numMergedOcc 0
5 mol 25 unq 2 iso 0 dist 6.22122 9.95169 5.68041 4.96681 7.17969 9.48085 6.63966 7.55264 6.53269 6.08585 numMergedOcc 0
6 mol 25 unq 3 iso 0 dist 6.22122 9.95169 5.68041 4.96681 7.17969 9.48085 7.66414 10.3593 9.81524 9.15781 numMergedOcc 0
7 mol 72 unq 0 iso 0 dist 6.68311 9.26417 4.03844 8.1124 8.8178 12.4827 15.1138 9.27838 6.91169 15.434 numMergedOcc 0
8 mol 72 unq 1 iso 0 dist 6.68311 9.26417 4.03844 15.0607 9.96708 12.111 15.1138 9.27838 6.91169 11.6378 numMergedOcc 0
9 mol 129 unq 0 iso 0 dist 6.23966 8.46972 6.28232 5.16275 9.61051 11.3039 5.85167 7.58957 6.34626 5.68211 numMergedOcc 0
10 mol 129 unq 1 iso 0 dist 6.23966 8.46972 6.28232 6.65856 5.83384 11.7541 5.85167 7.58957 6.34626 10.5488 numMergedOcc 0
11 mol 155 unq 0 iso 0 dist 5.68636 8.14405 4.91785 7.92939 6.43582 8.97626 5.52764 7.92304 9.16358 5.50031 numMergedOcc 0
12 mol 155 unq 1 iso 0 dist 5.68636 8.14405 4.91785 7.92939 6.43582 8.97626 11.0203 10.3161 9.24038 6.89781 numMergedOcc 0
13 mol 222 unq 0 iso 0 dist 5.47561 8.51427 6.84862 10.6375 8.01589 14.4477 10.3328 7.67576 8.43195 10.3151 numMergedOcc 0
14 mol 222 unq 1 iso 0 dist 5.47561 8.51427 6.84862 5.39098 7.7699 10.0233 10.3328 7.67576 8.43195 7.81022 numMergedOcc 0
15 mol 222 unq 2 iso 0 dist 5.47561 8.51427 6.84862 5.60111 7.21333 5.56538 10.3328 7.67576 8.43195 7.75656 numMergedOcc 0
16 mol 224 unq 0 iso 0 dist 9.73411 5.31916 7.05804 14.1073 8.95269 13.2325 7.45491 11.9653 9.25617 11.1545 numMergedOcc 0
17 mol 224 unq 1 iso 0 dist 9.73411 5.31916 7.05804 14.1073 8.95269 13.2325 5.77278 14.5387 9.05276 16.8238 numMergedOcc 0
18 mol 224 unq 2 iso 0 dist 9.73411 5.31916 7.05804 9.81806 6.57273 8.79428 7.45491 11.9653 9.25617 7.38836 numMergedOcc 0
19 mol 224 unq 3 iso 0 dist 9.73411 5.31916 7.05804 9.81806 6.57273 8.79428 5.77278 14.5387 9.05276 12.4832 numMergedOcc 0
20 mol 224 unq 4 iso 0 dist 9.73411 5.31916 7.05804 5.99647 5.78342 6.8692 7.45491 11.9653 9.25617 10.6079 numMergedOcc 0
21 mol 224 unq 5 iso 0 dist 9.73411 5.31916 7.05804 5.99647 5.78342 6.8692 5.77278 14.5387 9.05276 11.5752 numMergedOcc 0
22 mol 224 unq 6 iso 0 dist 7.75485 5.31916 4.54188 5.99647 5.81334 6.8692 7.45491 12.9355 9.25617 10.6079 numMergedOcc 0
23 mol 224 unq 7 iso 0 dist 7.75485 5.31916 4.54188 5.99647 5.81334 6.8692 5.77278 12.8311 9.05276 11.5752 numMergedOcc 0
24 mol 232 unq 0 iso 0 dist 9.95045 7.53576 5.42461 12.5761 8.27212 10.3021 4.95971 9.05071 6.59036 8.80479 numMergedOcc 0
25 mol 258 unq 0 iso 0 dist 8.44862 5.8804 8.74421 10.4505 6.97229 9.17612 8.02986 10.935 7.95464 6.93678 numMergedOcc 0
