0 mol 16 unq 0 iso 0 dist 9.56648 9.05346 5.1298 5.48395 5.84479 5.47769 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 9.56648 9.05346 5.1298 10.1011 8.67719 6.58035 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 5.70814 8.68726 9.54 6.8958 6.48625 12.4686 numMergedOcc 0
3 mol 67 unq 0 iso 0 dist 6.23298 5.70192 5.52457 11.8103 9.9348 10.9168 numMergedOcc 0
4 mol 67 unq 1 iso 0 dist 9.85405 7.65646 5.52457 10.4042 9.9348 10.9168 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 9.93688 7.57958 5.02124 4.71849 9.514 5.81965 numMergedOcc 0
6 mol 92 unq 1 iso 0 dist 9.93688 7.57958 5.02124 4.32564 7.84888 7.06013 numMergedOcc 0
7 mol 100 unq 0 iso 0 dist 6.97361 7.90328 5.07584 5.89399 7.88564 4.76815 numMergedOcc 0
8 mol 100 unq 1 iso 0 dist 8.52125 7.90328 7.59628 5.89399 6.78459 4.76815 numMergedOcc 0
9 mol 110 unq 0 iso 0 dist 5.43052 9.29817 5.17209 9.24029 7.21229 11.7786 numMergedOcc 0
10 mol 110 unq 1 iso 0 dist 5.43052 9.29817 5.17209 8.50777 5.25492 9.24502 numMergedOcc 0
11 mol 117 unq 0 iso 0 dist 6.81489 8.0578 9.30367 10.0087 7.70533 13.4462 numMergedOcc 0
12 mol 119 unq 0 iso 0 dist 5.28955 9.47892 8.00732 10.7421 9.93703 10.5042 numMergedOcc 0
13 mol 143 unq 0 iso 0 dist 5.46716 9.9492 6.50232 9.79072 9.61081 7.31468 numMergedOcc 0
14 mol 143 unq 1 iso 0 dist 5.46716 9.9492 6.50232 5.80488 5.46922 7.7056 numMergedOcc 0
15 mol 155 unq 0 iso 0 dist 6.53806 9.89699 5.15684 9.88413 7.02715 10.8056 numMergedOcc 0
16 mol 155 unq 1 iso 0 dist 6.53806 9.16944 5.84938 9.88413 7.02715 8.87452 numMergedOcc 0
17 mol 183 unq 0 iso 0 dist 9.92635 7.42108 16.8061 10.0008 7.31181 15.1331 numMergedOcc 0
18 mol 197 unq 0 iso 0 dist 6.50727 8.32685 5.92782 4.83116 9.5331 12.3899 numMergedOcc 0
19 mol 197 unq 1 iso 0 dist 7.84826 6.74777 5.92782 10.1332 9.5331 12.3899 numMergedOcc 0
20 mol 197 unq 2 iso 0 dist 7.56537 9.62514 10.1284 4.57437 8.64255 8.99696 numMergedOcc 0
21 mol 219 unq 0 iso 0 dist 8.62654 7.15624 10.2112 9.31035 9.77442 15.3191 numMergedOcc 0
22 mol 226 unq 0 iso 0 dist 8.10096 9.31669 6.05562 5.47434 9.5723 13.3023 numMergedOcc 0
23 mol 227 unq 0 iso 0 dist 6.14732 8.82471 6.07589 10.9746 9.18675 5.86443 numMergedOcc 0
24 mol 234 unq 0 iso 0 dist 9.36753 7.24774 11.9454 12.0816 5.89084 16.1247 numMergedOcc 0
25 mol 234 unq 1 iso 0 dist 9.36753 7.24774 11.9454 6.94762 8.47009 11.1284 numMergedOcc 0
26 mol 238 unq 0 iso 0 dist 9.46728 9.46582 6.23871 11.9383 6.83152 12.0632 numMergedOcc 0
27 mol 238 unq 1 iso 0 dist 9.46728 9.46582 6.23871 9.23693 5.24313 7.67322 numMergedOcc 0
28 mol 238 unq 2 iso 0 dist 9.46728 9.77231 10.1372 11.9383 6.83152 16.3609 numMergedOcc 0
29 mol 238 unq 3 iso 0 dist 9.46728 9.77231 10.1372 9.23693 5.24313 12.3367 numMergedOcc 0
30 mol 259 unq 0 iso 0 dist 5.22111 8.46351 9.53336 5.41945 7.93997 10.4634 numMergedOcc 0
31 mol 274 unq 0 iso 0 dist 8.26851 8.62431 4.05661 4.56913 6.00877 6.50589 numMergedOcc 0
32 mol 274 unq 1 iso 0 dist 8.14634 8.62431 7.47324 4.56913 8.66451 6.50589 numMergedOcc 0
