0 mol 8 unq 0 iso 0 dist 5.38703 4.81384 8.79697 8.16743 8.93691 6.26865 numMergedOcc 0
1 mol 64 unq 0 iso 0 dist 9.82294 12.954 7.77991 15.501 9.19912 8.06829 numMergedOcc 0
2 mol 64 unq 1 iso 0 dist 9.82294 6.84612 5.1488 10.6144 4.56868 8.4517 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 7.5434 4.42702 7.58673 11.726 9.47947 9.46312 numMergedOcc 0
4 mol 114 unq 0 iso 0 dist 8.79677 8.32999 6.06039 14.9408 13.312 9.86739 numMergedOcc 0
5 mol 114 unq 1 iso 0 dist 8.79677 8.32999 6.06039 16.206 10.7702 8.39249 numMergedOcc 0
6 mol 114 unq 2 iso 0 dist 8.79677 8.32999 6.06039 11.8658 5.06074 8.93623 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 5.84909 6.2062 7.46812 15.1748 12.3706 9.94276 numMergedOcc 0
8 mol 133 unq 1 iso 0 dist 5.84909 6.2062 7.46812 13.8795 12.9387 9.05357 numMergedOcc 0
9 mol 133 unq 2 iso 0 dist 5.84909 6.2062 7.46812 8.9344 5.28979 5.99299 numMergedOcc 0
10 mol 157 unq 0 iso 0 dist 8.78412 9.06676 8.18826 15.3492 10.1862 7.23499 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 8.90161 4.24915 5.89833 9.15368 6.72205 8.20656 numMergedOcc 0
12 mol 181 unq 1 iso 0 dist 8.90161 4.24915 5.89833 7.96182 10.7557 9.40622 numMergedOcc 0
13 mol 181 unq 2 iso 0 dist 7.11262 4.20499 5.89833 11.6365 6.72205 8.20656 numMergedOcc 0
14 mol 181 unq 3 iso 0 dist 7.11262 4.20499 5.89833 13.0537 10.7557 9.40622 numMergedOcc 0
15 mol 181 unq 4 iso 0 dist 6.60648 6.39513 5.89833 12.4394 6.72205 8.20656 numMergedOcc 0
16 mol 181 unq 5 iso 0 dist 6.60648 6.39513 5.89833 15.301 10.7557 9.40622 numMergedOcc 0
17 mol 193 unq 0 iso 0 dist 6.66555 7.57363 6.00381 10.317 5.12102 6.33838 numMergedOcc 0
18 mol 213 unq 0 iso 0 dist 4.40476 4.23514 7.48151 12.1351 13.6126 8.74171 numMergedOcc 0
19 mol 213 unq 1 iso 0 dist 4.40476 4.23514 7.48151 10.1374 11.1543 6.85195 numMergedOcc 0
20 mol 213 unq 2 iso 0 dist 4.40476 6.58235 8.58039 10.1374 11.1543 6.17451 numMergedOcc 0
21 mol 233 unq 0 iso 0 dist 9.72186 8.95188 7.6416 16.8721 9.09804 9.2911 numMergedOcc 0
22 mol 233 unq 1 iso 0 dist 8.39315 5.19341 7.6416 10.3183 9.09804 9.2911 numMergedOcc 0
