0 mol 21 unq 0 iso 0 dist 8.32279 4.82549 5.40424 6.5268 11.2749 6.08338 numMergedOcc 0
1 mol 70 unq 0 iso 0 dist 8.35292 8.06918 13.6191 9.17087 17.3937 8.33704 numMergedOcc 0
2 mol 70 unq 1 iso 0 dist 8.35292 8.06918 13.6191 5.33532 13.5161 7.92394 numMergedOcc 0
3 mol 70 unq 2 iso 0 dist 8.35292 7.52623 10.3189 5.33532 13.5161 9.93423 numMergedOcc 0
4 mol 70 unq 3 iso 0 dist 8.35292 5.62294 7.45004 5.33532 13.5161 9.34122 numMergedOcc 0
5 mol 70 unq 4 iso 0 dist 7.9945 8.56968 13.6191 12.189 17.3937 8.33704 numMergedOcc 0
6 mol 70 unq 5 iso 0 dist 7.9945 8.56968 13.6191 7.6455 13.5161 7.92394 numMergedOcc 0
7 mol 70 unq 6 iso 0 dist 7.9945 7.31655 10.3189 7.6455 13.5161 9.93423 numMergedOcc 0
8 mol 70 unq 7 iso 0 dist 7.9945 7.99569 7.45004 7.6455 13.5161 9.34122 numMergedOcc 0
9 mol 105 unq 0 iso 0 dist 7.89766 8.32431 11.9362 10.5413 17.4691 8.36733 numMergedOcc 0
10 mol 113 unq 0 iso 0 dist 7.61296 8.94447 10.2828 12.7099 15.0929 6.81812 numMergedOcc 0
11 mol 115 unq 0 iso 0 dist 6.06325 5.43229 5.0062 5.98221 9.79979 7.76729 numMergedOcc 0
12 mol 204 unq 0 iso 0 dist 9.56851 8.87757 4.71843 11.4265 9.92686 9.59333 numMergedOcc 0
13 mol 220 unq 0 iso 0 dist 9.63451 5.13604 6.66326 4.8419 11.8783 7.61951 numMergedOcc 0
14 mol 225 unq 0 iso 0 dist 9.32657 6.31342 6.81372 6.9955 11.4745 5.50387 numMergedOcc 0
15 mol 227 unq 0 iso 0 dist 5.46388 6.06804 5.66663 7.39364 10.4039 5.86443 numMergedOcc 0
16 mol 235 unq 0 iso 0 dist 9.08448 6.43838 4.25998 5.06584 6.56775 5.65339 numMergedOcc 0
17 mol 235 unq 1 iso 0 dist 9.08448 9.24964 17.7548 6.70342 14.469 9.58736 numMergedOcc 0
18 mol 235 unq 2 iso 0 dist 9.08448 9.24964 17.7548 6.38281 10.8773 9.43058 numMergedOcc 0
19 mol 235 unq 3 iso 0 dist 9.08448 9.24964 17.7548 10.6146 15.3413 8.75735 numMergedOcc 0
20 mol 235 unq 4 iso 0 dist 9.08448 9.24964 17.7548 14.8599 22.2246 6.98084 numMergedOcc 0
21 mol 235 unq 5 iso 0 dist 9.08448 9.24964 17.7548 16.2392 24.3124 7.32211 numMergedOcc 0
22 mol 235 unq 6 iso 0 dist 9.27776 5.71896 7.62542 6.01036 7.8128 9.58736 numMergedOcc 0
23 mol 235 unq 7 iso 0 dist 9.27776 5.71896 7.62542 4.99641 14.0788 9.43058 numMergedOcc 0
24 mol 235 unq 8 iso 0 dist 9.27776 5.71896 7.62542 7.72505 15.6618 8.75735 numMergedOcc 0
25 mol 235 unq 9 iso 0 dist 9.27776 5.71896 7.62542 12.2179 12.4284 6.98084 numMergedOcc 0
26 mol 235 unq 10 iso 0 dist 9.27776 5.71896 7.62542 11.7282 12.9661 7.32211 numMergedOcc 0
27 mol 238 unq 0 iso 0 dist 6.05376 6.89216 4.77757 11.0676 11.5605 6.91569 numMergedOcc 0
28 mol 253 unq 0 iso 0 dist 5.2691 7.83041 8.71428 12.3321 13.0194 7.19465 numMergedOcc 0
29 mol 264 unq 0 iso 0 dist 7.2692 5.50677 10.4146 14.447 17.447 9.0012 numMergedOcc 0
30 mol 264 unq 1 iso 0 dist 7.2692 8.75957 9.42113 14.447 17.447 9.5784 numMergedOcc 0
31 mol 264 unq 2 iso 0 dist 6.5477 5.50677 5.01317 14.447 11.1714 9.0012 numMergedOcc 0
32 mol 264 unq 3 iso 0 dist 6.5477 8.75957 10.1289 14.447 11.1714 9.5784 numMergedOcc 0
