0 mol 43 unq 0 iso 0 dist 7.7961 9.2958 5.37778 7.09975 9.38335 13.2633 numMergedOcc 0
1 mol 64 unq 0 iso 0 dist 6.48746 8.85601 4.24381 5.40109 6.23138 9.68314 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 9.073 7.51631 10.0937 13.0367 7.07989 14.2533 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 6.39759 7.06722 6.29901 10.2731 9.18898 14.8897 numMergedOcc 0
4 mol 92 unq 1 iso 0 dist 6.39759 7.06722 6.29901 4.66752 7.67331 11.07 numMergedOcc 0
5 mol 95 unq 0 iso 0 dist 6.82522 6.54247 4.56119 11.756 9.49995 13.5626 numMergedOcc 0
6 mol 98 unq 0 iso 0 dist 6.17173 5.58102 3.78499 5.91879 8.41411 7.55367 numMergedOcc 0
7 mol 113 unq 0 iso 0 dist 7.92498 6.61697 7.1034 5.60987 5.37302 6.23759 numMergedOcc 0
8 mol 128 unq 0 iso 0 dist 5.32517 7.12662 8.30851 5.8344 8.87314 11.8543 numMergedOcc 0
9 mol 128 unq 1 iso 0 dist 5.32517 9.38 12.0704 5.8344 8.87314 12.3001 numMergedOcc 0
10 mol 128 unq 2 iso 0 dist 8.88867 7.12662 7.67031 5.8344 9.49761 11.8543 numMergedOcc 0
11 mol 128 unq 3 iso 0 dist 8.88867 7.12662 7.67031 10.172 6.03154 10.8446 numMergedOcc 0
12 mol 128 unq 4 iso 0 dist 8.88867 9.38 4.62046 5.8344 9.49761 12.3001 numMergedOcc 0
13 mol 128 unq 5 iso 0 dist 8.88867 9.38 4.62046 10.172 6.03154 7.4442 numMergedOcc 0
14 mol 128 unq 6 iso 0 dist 7.04282 7.12662 4.79627 5.8344 9.38436 11.8543 numMergedOcc 0
15 mol 128 unq 7 iso 0 dist 7.04282 9.38 4.769 5.8344 9.38436 12.3001 numMergedOcc 0
16 mol 141 unq 0 iso 0 dist 8.47476 5.96324 12.4943 14.894 7.6793 16.7237 numMergedOcc 0
17 mol 141 unq 1 iso 0 dist 8.47476 9.22913 6 14.894 7.6793 6.75593 numMergedOcc 0
18 mol 141 unq 2 iso 0 dist 6.74947 5.96324 5.51254 10.7523 8.01453 9.62774 numMergedOcc 0
19 mol 141 unq 3 iso 0 dist 6.74947 9.22913 14.501 10.7523 8.01453 17.4421 numMergedOcc 0
20 mol 169 unq 0 iso 0 dist 8.11268 6.85177 7.16323 5.50901 5.51388 6.35799 numMergedOcc 0
21 mol 169 unq 1 iso 0 dist 8.11268 8.88729 11.9514 5.50901 5.51388 10.8214 numMergedOcc 0
22 mol 205 unq 0 iso 0 dist 5.91079 4.72209 3.83801 5.68053 5.86419 7.75318 numMergedOcc 0
23 mol 260 unq 0 iso 0 dist 7.46 8.90109 3.43711 8.565 5.68717 6.12343 numMergedOcc 0
