0 mol 16 unq 0 iso 0 dist 9.56648 9.05346 5.1298 5.48395 5.84479 5.47769 4.78943 9.18436 7.03948 6.92781 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 9.56648 9.05346 5.1298 5.48395 5.84479 5.47769 10.1011 8.67719 6.58035 5.32694 numMergedOcc 0
2 mol 16 unq 2 iso 0 dist 9.56648 9.05346 5.1298 10.1011 8.67719 6.58035 4.78943 9.18436 7.03948 10.7015 numMergedOcc 0
3 mol 16 unq 3 iso 0 dist 9.56648 9.05346 5.1298 10.1011 8.67719 6.58035 5.48395 5.84479 5.47769 5.32694 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 5.70814 8.68726 9.54 6.8958 6.48625 12.4686 10.8906 14.6344 8.24062 17.0843 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 9.93688 7.57958 5.02124 4.71849 9.514 5.81965 4.32564 7.84888 7.06013 5.02055 numMergedOcc 0
6 mol 92 unq 1 iso 0 dist 9.93688 7.57958 5.02124 4.71849 9.514 5.81965 13.6329 13.0248 9.70512 8.95922 numMergedOcc 0
7 mol 92 unq 2 iso 0 dist 9.93688 7.57958 5.02124 4.32564 7.84888 7.06013 4.71849 9.514 5.81965 5.02055 numMergedOcc 0
8 mol 92 unq 3 iso 0 dist 9.93688 7.57958 5.02124 4.32564 7.84888 7.06013 13.6329 13.0248 9.70512 12.4494 numMergedOcc 0
9 mol 100 unq 0 iso 0 dist 6.97361 7.90328 5.07584 5.89399 7.88564 4.76815 10.071 11.4822 9.39469 6.90824 numMergedOcc 0
10 mol 100 unq 1 iso 0 dist 8.52125 7.90328 7.59628 5.89399 6.78459 4.76815 10.071 13.6378 9.39469 6.90824 numMergedOcc 0
11 mol 117 unq 0 iso 0 dist 6.81489 8.0578 9.30367 10.0087 7.70533 13.4462 11.1675 10.5232 7.20326 10.4345 numMergedOcc 0
12 mol 119 unq 0 iso 0 dist 5.28955 9.47892 8.00732 10.7421 9.93703 10.5042 9.58951 11.3088 7.39889 8.61848 numMergedOcc 0
13 mol 119 unq 1 iso 0 dist 5.28955 9.47892 8.00732 10.7421 9.93703 10.5042 18.2257 17.6376 9.63176 17.2349 numMergedOcc 0
14 mol 119 unq 2 iso 0 dist 5.28955 9.47892 8.00732 10.7421 9.93703 10.5042 9.93013 10.517 7.44174 16.573 numMergedOcc 0
15 mol 143 unq 0 iso 0 dist 5.46716 9.9492 6.50232 9.79072 9.61081 7.31468 5.80488 5.46922 7.7056 5.72828 numMergedOcc 0
16 mol 143 unq 1 iso 0 dist 5.46716 9.9492 6.50232 5.80488 5.46922 7.7056 9.79072 9.61081 7.31468 5.72828 numMergedOcc 0
17 mol 155 unq 0 iso 0 dist 6.53806 9.16944 5.84938 9.88413 7.02715 8.87452 5.01118 9.70079 9.17284 12.1545 numMergedOcc 0
18 mol 155 unq 1 iso 0 dist 6.53806 9.16944 5.84938 9.88413 7.02715 8.87452 10.1253 9.83554 9.87281 4.66274 numMergedOcc 0
19 mol 183 unq 0 iso 0 dist 9.92635 7.42108 16.8061 10.0008 7.31181 15.1331 4.81807 9.34207 9.93083 6.37803 numMergedOcc 0
20 mol 183 unq 1 iso 0 dist 9.92635 7.42108 16.8061 10.0008 7.31181 15.1331 7.79648 15.8696 7.01383 12.1431 numMergedOcc 0
21 mol 197 unq 0 iso 0 dist 6.50727 8.32685 5.92782 4.83116 9.5331 12.3899 10.5326 11.0336 8.99696 15.2559 numMergedOcc 0
22 mol 197 unq 1 iso 0 dist 7.84826 6.74777 5.92782 10.1332 9.5331 12.3899 5.29309 11.0336 8.99696 15.2559 numMergedOcc 0
23 mol 238 unq 0 iso 0 dist 9.46728 9.46582 6.23871 11.9383 6.83152 12.0632 9.23693 5.24313 7.67322 5.42006 numMergedOcc 0
24 mol 238 unq 1 iso 0 dist 9.46728 9.77231 10.1372 11.9383 6.83152 16.3609 15.3161 16.8553 9.68513 21.603 numMergedOcc 0
25 mol 238 unq 2 iso 0 dist 9.46728 9.77231 10.1372 11.9383 6.83152 16.3609 9.18011 16.0821 9.29858 20.092 numMergedOcc 0
26 mol 238 unq 3 iso 0 dist 9.46728 9.77231 10.1372 9.23693 5.24313 12.3367 15.3161 16.8553 9.68513 16.2992 numMergedOcc 0
27 mol 238 unq 4 iso 0 dist 9.46728 9.77231 10.1372 9.23693 5.24313 12.3367 9.18011 16.0821 9.29858 15.7907 numMergedOcc 0
28 mol 259 unq 0 iso 0 dist 5.22111 8.46351 9.53336 5.41945 7.93997 10.4634 5.59901 9.52383 7.76676 9.98105 numMergedOcc 0
