0 mol 18 unq 0 iso 0 dist 6.79099 13.1537 8.51213 13.4014 9.51761 11.0081 numMergedOcc 0
1 mol 18 unq 1 iso 0 dist 6.79099 13.1537 8.51213 5.27833 7.3094 11.3758 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 9.15677 14.8485 7.34549 16.4682 8.34347 4.76147 numMergedOcc 0
3 mol 26 unq 1 iso 0 dist 9.15677 16.9454 8.09068 16.4682 8.34347 6.30129 numMergedOcc 0
4 mol 26 unq 2 iso 0 dist 9.15677 17.4951 9.72289 16.4682 8.34347 5.93227 numMergedOcc 0
5 mol 26 unq 3 iso 0 dist 9.61029 11.9913 7.34549 14.3476 8.34347 4.76147 numMergedOcc 0
6 mol 26 unq 4 iso 0 dist 9.61029 11.6671 8.09068 14.3476 8.34347 6.30129 numMergedOcc 0
7 mol 26 unq 5 iso 0 dist 9.61029 15.9266 9.72289 14.3476 8.34347 5.93227 numMergedOcc 0
8 mol 54 unq 0 iso 0 dist 7.51978 6.11985 6.13476 10.6355 9.5589 13.1047 numMergedOcc 0
9 mol 54 unq 1 iso 0 dist 7.51978 6.11985 6.13476 6.43082 6.83299 10.0565 numMergedOcc 0
10 mol 54 unq 2 iso 0 dist 7.51978 6.11985 6.13476 11.7347 8.10861 5.77448 numMergedOcc 0
11 mol 95 unq 0 iso 0 dist 6.05043 11.1228 9.17862 6.40193 7.27724 15.821 numMergedOcc 0
12 mol 95 unq 1 iso 0 dist 6.05043 6.99612 8.27456 6.40193 7.27724 9.7565 numMergedOcc 0
13 mol 122 unq 0 iso 0 dist 5.09114 11.2576 8.054 6.01457 8.37808 9.57532 numMergedOcc 0
14 mol 127 unq 0 iso 0 dist 9.79448 7.11155 8.09965 7.78467 8.14887 8.45411 numMergedOcc 0
15 mol 127 unq 1 iso 0 dist 9.79448 7.11155 8.09965 6.02237 9.30299 11.3174 numMergedOcc 0
16 mol 129 unq 0 iso 0 dist 8.14071 9.30769 6.47346 13.1328 5.83384 6.90896 numMergedOcc 0
17 mol 175 unq 0 iso 0 dist 8.50904 9.52671 7.94593 8.09861 9.0018 13.2723 numMergedOcc 0
18 mol 175 unq 1 iso 0 dist 8.50904 9.52671 7.94593 10.1323 7.652 8.63795 numMergedOcc 0
19 mol 178 unq 0 iso 0 dist 6.01118 7.09944 5.41229 9.73148 6.69288 4.51874 numMergedOcc 0
20 mol 181 unq 0 iso 0 dist 6.96824 6.57868 9.50454 8.76337 7.63312 11.755 numMergedOcc 0
21 mol 181 unq 1 iso 0 dist 6.96824 8.05561 8.80581 8.76337 7.63312 10.209 numMergedOcc 0
22 mol 181 unq 2 iso 0 dist 9.25528 6.57868 7.15963 18.2027 9.1374 14.1493 numMergedOcc 0
23 mol 181 unq 3 iso 0 dist 9.25528 6.57868 7.15963 11.4901 5.98885 6.73556 numMergedOcc 0
24 mol 181 unq 4 iso 0 dist 9.25528 6.57868 7.15963 11.9545 9.15386 5.49666 numMergedOcc 0
25 mol 204 unq 0 iso 0 dist 7.92766 10.7365 6.20646 14.0488 7.10633 5.21426 numMergedOcc 0
26 mol 204 unq 1 iso 0 dist 7.92766 10.7365 6.20646 7.58285 8.51516 8.35604 numMergedOcc 0
27 mol 204 unq 2 iso 0 dist 7.92766 14.1382 6.73266 14.0488 7.10633 5.57112 numMergedOcc 0
28 mol 204 unq 3 iso 0 dist 7.92766 14.1382 6.73266 7.58285 8.51516 12.1292 numMergedOcc 0
29 mol 206 unq 0 iso 0 dist 8.59262 8.99076 7.51923 4.38308 8.02137 5.39127 numMergedOcc 0
30 mol 206 unq 1 iso 0 dist 8.59262 8.99076 7.51923 13.472 9.774 5.1071 numMergedOcc 0
31 mol 210 unq 0 iso 0 dist 7.19917 8.78987 7.86668 9.55205 6.18308 5.06314 numMergedOcc 0
32 mol 238 unq 0 iso 0 dist 9.82174 8.0362 8.39522 10.4397 6.57393 4.88998 numMergedOcc 0
33 mol 238 unq 1 iso 0 dist 9.2521 8.0362 5.99187 12.8083 6.22714 5.74685 numMergedOcc 0
34 mol 238 unq 2 iso 0 dist 9.2521 8.0362 5.99187 10.1821 7.31233 5.87189 numMergedOcc 0
35 mol 241 unq 0 iso 0 dist 8.62971 12.263 8.18588 4.99503 7.4631 10.2076 numMergedOcc 0
36 mol 253 unq 0 iso 0 dist 5.76077 12.8509 9.86979 9.0081 9.02271 7.79167 numMergedOcc 0
37 mol 253 unq 1 iso 0 dist 7.0247 11.3218 9.86979 10.9027 9.02271 7.79167 numMergedOcc 0
38 mol 261 unq 0 iso 0 dist 7.26647 6.15322 6.85589 4.95196 7.73141 5.85483 numMergedOcc 0
39 mol 261 unq 1 iso 0 dist 7.26647 6.15322 6.85589 9.29412 8.43057 4.31412 numMergedOcc 0
40 mol 261 unq 2 iso 0 dist 7.7309 6.15322 6.68878 9.29412 6.05727 4.31412 numMergedOcc 0
41 mol 279 unq 0 iso 0 dist 8.27977 11.9125 7.63115 13.1217 9.70696 5.82892 numMergedOcc 0
42 mol 282 unq 0 iso 0 dist 7.70229 5.9433 7.34596 8.93697 8.76532 4.36798 numMergedOcc 0
43 mol 282 unq 1 iso 0 dist 7.90792 5.9433 7.12228 8.93697 6.33524 4.36798 numMergedOcc 0
