0 mol 25 unq 0 iso 0 dist 7.0928 6.98291 9.20601 11.7941 7.05196 12.8378 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 9.16827 9.32155 5.48048 10.4149 6.75943 7.15901 numMergedOcc 0
2 mol 58 unq 0 iso 0 dist 7.04193 8.49198 5.53601 7.43516 9.97769 14.1945 numMergedOcc 0
3 mol 58 unq 1 iso 0 dist 7.04193 9.57633 7.40296 7.43516 9.97769 6.87028 numMergedOcc 0
4 mol 58 unq 2 iso 0 dist 7.15486 8.49198 10.7769 7.43516 9.08221 14.1945 numMergedOcc 0
5 mol 58 unq 3 iso 0 dist 7.15486 9.57633 6.37648 7.43516 9.08221 6.87028 numMergedOcc 0
6 mol 89 unq 0 iso 0 dist 9.51842 6.17795 6.52312 8.74594 6.53308 10.1877 numMergedOcc 0
7 mol 89 unq 1 iso 0 dist 9.51842 6.17795 6.52312 5.87704 7.47974 6.65534 numMergedOcc 0
8 mol 89 unq 2 iso 0 dist 8.25651 6.17795 6.60299 5.87704 5.51831 6.65534 numMergedOcc 0
9 mol 92 unq 0 iso 0 dist 8.22406 8.99661 7.24315 4.57682 9.36001 6.98037 numMergedOcc 0
10 mol 112 unq 0 iso 0 dist 7.63658 5.82495 11.7428 7.35282 9.05166 9.95184 numMergedOcc 0
11 mol 112 unq 1 iso 0 dist 7.63658 5.82495 11.7428 8.43423 5.56994 11.2454 numMergedOcc 0
12 mol 119 unq 0 iso 0 dist 8.59784 9.89116 3.78311 13.4766 7.64052 9.57341 numMergedOcc 0
13 mol 143 unq 0 iso 0 dist 8.72463 7.52352 10.8441 7.21648 7.36975 13.5717 numMergedOcc 0
14 mol 143 unq 1 iso 0 dist 8.72463 7.52352 10.8441 9.42107 5.40637 8.68663 numMergedOcc 0
15 mol 178 unq 0 iso 0 dist 6.01118 7.25142 7.17024 5.23156 7.06025 10.8216 numMergedOcc 0
16 mol 205 unq 0 iso 0 dist 7.36642 9.8747 5.54129 8.66359 6.52816 7.53395 numMergedOcc 0
17 mol 205 unq 1 iso 0 dist 7.36642 8.01082 5.28092 8.66359 6.52816 10.183 numMergedOcc 0
18 mol 213 unq 0 iso 0 dist 9.06306 7.5552 12.2697 4.44853 7.94911 9.62911 numMergedOcc 0
19 mol 213 unq 1 iso 0 dist 9.06306 8.10336 7.04114 4.44853 7.94911 10.4519 numMergedOcc 0
20 mol 238 unq 0 iso 0 dist 7.62771 6.52129 5.87253 14.7797 8.82351 11.2897 numMergedOcc 0
21 mol 238 unq 1 iso 0 dist 7.80166 6.52129 10.7551 6.10342 9.72188 6.53286 numMergedOcc 0
22 mol 292 unq 0 iso 0 dist 6.8133 9.57102 7.61567 11.4338 9.9182 14.5087 numMergedOcc 0
23 mol 292 unq 1 iso 0 dist 6.8133 9.57102 7.61567 12.3949 8.9221 16.4438 numMergedOcc 0
