0 mol 7 unq 0 iso 0 dist 9.34656 15.0884 6.36911 17.5535 9.97624 5.03847 13.0935 6.06176 8.41585 10.3148 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.34656 6.3236 9.36807 17.5535 9.97624 13.8829 12.8676 10.515 7.10621 8.72114 numMergedOcc 0
2 mol 70 unq 0 iso 0 dist 8.06918 5.33532 7.92394 13.012 9.48582 8.34216 6.77833 6.65811 9.65964 14.4968 numMergedOcc 0
3 mol 70 unq 1 iso 0 dist 8.56968 7.6455 7.92394 13.7078 9.48582 8.34216 9.83265 6.65811 9.65964 14.4968 numMergedOcc 0
4 mol 70 unq 2 iso 0 dist 7.70428 7.61147 7.92394 5.98585 9.48582 8.34216 13.4706 6.65811 9.65964 14.4968 numMergedOcc 0
5 mol 100 unq 0 iso 0 dist 9.0405 9.7939 8.72704 5.16528 6.0652 10.6245 12.0862 7.2495 6.45675 9.91958 numMergedOcc 0
6 mol 100 unq 1 iso 0 dist 9.0405 9.7939 8.72704 5.16528 6.0652 10.6245 10.6961 10.1589 7.47343 9.5074 numMergedOcc 0
7 mol 100 unq 2 iso 0 dist 9.0405 9.7939 8.72704 5.16528 6.0652 10.6245 17.8864 15.9331 8.86688 18.0561 numMergedOcc 0
8 mol 115 unq 0 iso 0 dist 5.43229 5.98221 7.76729 11.6661 7.70313 14.0688 13.352 10.7942 9.33865 13.3009 numMergedOcc 0
9 mol 115 unq 1 iso 0 dist 5.43229 5.98221 7.76729 11.6661 7.70313 14.0688 11.172 10.9739 5.83991 17.0848 numMergedOcc 0
10 mol 126 unq 0 iso 0 dist 6.35364 8.50279 7.75534 11.4029 7.36017 6.0268 11.0723 7.01257 6.06638 6.30546 numMergedOcc 0
11 mol 126 unq 1 iso 0 dist 6.35364 8.50279 7.75534 7.05454 5.14819 8.01268 11.0723 7.01257 6.06638 10.0699 numMergedOcc 0
12 mol 126 unq 2 iso 0 dist 6.35364 8.50279 7.75534 4.95023 6.84245 10.2072 11.0723 7.01257 6.06638 12.8712 numMergedOcc 0
13 mol 133 unq 0 iso 0 dist 9.59094 11.0811 7.92688 12.0166 6.51868 5.92062 8.95433 4.68409 7.11802 9.22661 numMergedOcc 0
14 mol 133 unq 1 iso 0 dist 9.59094 11.0811 7.92688 12.0166 6.51868 5.92062 13.7786 12.2037 8.00618 13.5028 numMergedOcc 0
15 mol 133 unq 2 iso 0 dist 9.59094 11.0811 7.92688 5.14992 7.34698 6.61891 8.95433 4.68409 7.11802 7.56378 numMergedOcc 0
16 mol 133 unq 3 iso 0 dist 9.59094 11.0811 7.92688 5.14992 7.34698 6.61891 13.7786 12.2037 8.00618 11.8433 numMergedOcc 0
17 mol 181 unq 0 iso 0 dist 5.55727 4.89429 7.13543 4.80772 6.32777 5.77299 10.4189 10.0524 5.98885 10.6908 numMergedOcc 0
18 mol 181 unq 1 iso 0 dist 5.55727 4.89429 7.13543 4.80772 6.32777 5.77299 8.27794 5.95965 9.09537 11.3325 numMergedOcc 0
19 mol 235 unq 0 iso 0 dist 9.24964 6.70342 9.58736 13.9329 7.31773 15.6327 6.45574 9.66021 5.4638 16.5425 numMergedOcc 0
20 mol 235 unq 1 iso 0 dist 5.71896 6.01036 9.58736 10.1328 7.31773 15.6327 8.14407 9.66021 5.4638 16.5425 numMergedOcc 0
21 mol 235 unq 2 iso 0 dist 8.3229 17.1296 9.58736 6.43382 7.31773 15.6327 15.9155 9.66021 5.4638 16.5425 numMergedOcc 0
22 mol 253 unq 0 iso 0 dist 7.83041 12.3321 7.19465 11.6772 9.58354 5.78064 15.7191 7.92528 9.02271 13.07 numMergedOcc 0
23 mol 264 unq 0 iso 0 dist 5.50677 14.447 9.0012 10.3381 5.91213 7.52936 12.7927 9.74238 9.361 13.2142 numMergedOcc 0
24 mol 264 unq 1 iso 0 dist 5.50677 14.447 9.0012 10.3381 5.91213 7.52936 10.1737 5.12409 6.24356 5.93616 numMergedOcc 0
25 mol 264 unq 2 iso 0 dist 8.75957 14.447 9.5784 10.3381 7.34094 7.52936 12.7927 9.85579 9.361 13.2142 numMergedOcc 0
26 mol 264 unq 3 iso 0 dist 8.75957 14.447 9.5784 10.3381 7.34094 7.52936 10.1737 9.67998 6.24356 5.93616 numMergedOcc 0
