0 mol 15 unq 0 iso 0 dist 4.89563 6.05868 6.82187 7.38118 8.4014 12.4204 numMergedOcc 0
1 mol 17 unq 0 iso 0 dist 9.55169 13.4017 8.58312 10.9885 8.70792 5.56803 numMergedOcc 0
2 mol 38 unq 0 iso 0 dist 4.82342 4.50998 9.30722 7.34619 7.68478 9.57959 numMergedOcc 0
3 mol 46 unq 0 iso 0 dist 8.37969 4.63066 9.86627 8.23958 9.45756 10.7471 numMergedOcc 0
4 mol 72 unq 0 iso 0 dist 7.09258 11.4333 8.4143 10.7286 6.62699 3.63735 numMergedOcc 0
5 mol 117 unq 0 iso 0 dist 6.97244 14.7727 9.32858 11.3762 7.78789 5.24084 numMergedOcc 0
6 mol 117 unq 1 iso 0 dist 6.97244 14.7727 9.32858 10.2106 7.42146 9.30266 numMergedOcc 0
7 mol 129 unq 0 iso 0 dist 6.1421 11.2993 8.00624 12.077 7.97548 6.61102 numMergedOcc 0
8 mol 129 unq 1 iso 0 dist 6.1421 11.2993 8.00624 10.5094 9.64164 9.0678 numMergedOcc 0
9 mol 129 unq 2 iso 0 dist 9.54663 12.8233 8.00624 9.45041 7.97548 6.61102 numMergedOcc 0
10 mol 129 unq 3 iso 0 dist 9.54663 12.8233 8.00624 5.50122 9.64164 9.0678 numMergedOcc 0
11 mol 147 unq 0 iso 0 dist 9.11046 12.2068 9.88662 5.76262 6.73617 10.0388 numMergedOcc 0
12 mol 147 unq 1 iso 0 dist 9.11046 12.2068 9.88662 4.09924 9.03544 9.71714 numMergedOcc 0
13 mol 168 unq 0 iso 0 dist 7.53748 7.36888 7.79893 4.18108 5.6125 3.60864 numMergedOcc 0
14 mol 197 unq 0 iso 0 dist 7.18765 5.71227 8.67786 15.4113 9.23086 14.0686 numMergedOcc 0
15 mol 241 unq 0 iso 0 dist 5.40961 11.461 7.73213 7.13208 7.52531 9.91137 numMergedOcc 0
16 mol 241 unq 1 iso 0 dist 8.74174 14.3843 7.73213 6.95297 7.52531 9.91137 numMergedOcc 0
17 mol 241 unq 2 iso 0 dist 5.57621 4.84723 7.73213 8.09397 7.52531 9.91137 numMergedOcc 0
18 mol 241 unq 3 iso 0 dist 8.28853 5.02161 7.73213 6.13288 7.52531 9.91137 numMergedOcc 0
19 mol 241 unq 4 iso 0 dist 8.71739 9.9688 7.73213 5.13491 7.52531 9.91137 numMergedOcc 0
20 mol 275 unq 0 iso 0 dist 9.94511 4.78957 8.33337 4.01643 8.81644 3.87632 numMergedOcc 0
21 mol 277 unq 0 iso 0 dist 6.86014 4.00063 4.81916 9.69757 4.9764 9.21484 numMergedOcc 0
22 mol 277 unq 1 iso 0 dist 6.86014 4.00063 4.81916 10.2113 6.36559 10.3506 numMergedOcc 0
23 mol 277 unq 2 iso 0 dist 5.97073 9.31316 4.81916 7.55695 4.9764 9.21484 numMergedOcc 0
24 mol 277 unq 3 iso 0 dist 5.97073 9.31316 4.81916 6.26644 6.36559 10.3506 numMergedOcc 0
25 mol 277 unq 4 iso 0 dist 6.49176 11.2565 4.81916 5.00704 4.9764 9.21484 numMergedOcc 0
26 mol 277 unq 5 iso 0 dist 6.49176 11.2565 4.81916 5.23954 6.36559 10.3506 numMergedOcc 0
27 mol 278 unq 0 iso 0 dist 6.23184 4.36007 6.84604 6.96416 5.35705 4.53664 numMergedOcc 0
