0 mol 7 unq 0 iso 0 dist 8.33249 5.47645 5.77374 12.4923 6.27507 7.49627 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.34604 5.47645 8.57437 5.45164 7.22054 9.21239 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 7.43675 13.394 8.57437 5.63672 7.22054 9.21239 numMergedOcc 0
3 mol 59 unq 0 iso 0 dist 6.5121 4.65487 9.14092 7.56102 9.65983 3.91888 numMergedOcc 0
4 mol 180 unq 0 iso 0 dist 8.00985 4.73248 8.24157 10.2951 7.67377 6.52202 numMergedOcc 0
5 mol 183 unq 0 iso 0 dist 6.5372 6.29417 9.86506 5.33914 6.0033 5.86369 numMergedOcc 0
6 mol 183 unq 1 iso 0 dist 6.5372 6.29417 9.86506 8.66911 9.01322 4.44329 numMergedOcc 0
7 mol 183 unq 2 iso 0 dist 6.44683 10.1111 9.86506 5.57205 6.0033 5.86369 numMergedOcc 0
8 mol 183 unq 3 iso 0 dist 6.44683 10.1111 9.86506 11.1805 9.01322 4.44329 numMergedOcc 0
9 mol 197 unq 0 iso 0 dist 8.24588 14.038 6.50727 7.71401 9.95181 13.1844 numMergedOcc 0
10 mol 197 unq 1 iso 0 dist 8.24588 15.6343 7.84826 7.71401 9.95181 14.3934 numMergedOcc 0
11 mol 197 unq 2 iso 0 dist 9.71675 6.68028 6.50727 12.7466 9.95181 13.1844 numMergedOcc 0
12 mol 197 unq 3 iso 0 dist 9.71675 4.58651 7.84826 12.7466 9.95181 14.3934 numMergedOcc 0
13 mol 222 unq 0 iso 0 dist 8.61558 11.1744 6.74371 4.99434 6.48536 8.9097 numMergedOcc 0
14 mol 232 unq 0 iso 0 dist 8.23266 6.26153 6.11539 3.7157 9.57701 6.12224 numMergedOcc 0
15 mol 232 unq 1 iso 0 dist 8.23266 6.26153 6.11539 15.2761 9.6048 13.6675 numMergedOcc 0
16 mol 232 unq 2 iso 0 dist 8.23266 8.73691 9.71082 3.7157 9.57701 11.9357 numMergedOcc 0
17 mol 232 unq 3 iso 0 dist 8.23266 8.73691 9.71082 15.2761 9.6048 19.1288 numMergedOcc 0
18 mol 244 unq 0 iso 0 dist 8.5122 5.92707 9.91271 14.7189 9.59814 11.4783 numMergedOcc 0
19 mol 244 unq 1 iso 0 dist 8.5122 5.92707 9.91271 4.99538 8.92083 4.30655 numMergedOcc 0
20 mol 266 unq 0 iso 0 dist 8.10271 10.604 9.33447 11.654 8.67354 5.40771 numMergedOcc 0
21 mol 266 unq 1 iso 0 dist 8.10271 5.75486 3.90274 11.654 8.67354 6.99177 numMergedOcc 0
22 mol 280 unq 0 iso 0 dist 9.27318 11.8962 7.10723 4.87788 9.93207 13.4787 numMergedOcc 0
23 mol 280 unq 1 iso 0 dist 9.27318 3.86473 6.8664 4.87788 9.93207 4.18107 numMergedOcc 0
