0 mol 18 unq 0 iso 0 dist 7.63261 9.00899 10.8265 5.98612 8.02671 14.2891 numMergedOcc 0
1 mol 18 unq 1 iso 0 dist 7.63261 9.00899 10.8265 6.05493 6.09533 12.7664 numMergedOcc 0
2 mol 18 unq 2 iso 0 dist 7.63261 7.826 13.2709 5.98612 8.02671 11.2766 numMergedOcc 0
3 mol 18 unq 3 iso 0 dist 7.63261 7.826 13.2709 6.05493 6.09533 12.8484 numMergedOcc 0
4 mol 44 unq 0 iso 0 dist 6.4519 6.86391 8.72795 3.93424 9.60845 9.71992 numMergedOcc 0
5 mol 78 unq 0 iso 0 dist 6.75455 8.06358 13.5499 11.1086 8.48827 13.3278 numMergedOcc 0
6 mol 78 unq 1 iso 0 dist 6.75455 8.06358 13.5499 10.2834 7.14048 12.9105 numMergedOcc 0
7 mol 78 unq 2 iso 0 dist 6.28063 8.06358 11.2152 11.1086 8.03895 13.3278 numMergedOcc 0
8 mol 78 unq 3 iso 0 dist 6.28063 8.06358 11.2152 10.2834 5.68873 12.9105 numMergedOcc 0
9 mol 81 unq 0 iso 0 dist 9.1024 7.062 7.58448 3.71214 9.53663 8.96045 numMergedOcc 0
10 mol 112 unq 0 iso 0 dist 9.9065 6.93938 3.82552 16.0647 9.60648 9.66492 numMergedOcc 0
11 mol 117 unq 0 iso 0 dist 9.31914 9.66392 12.4013 6.57911 6.01857 14.2322 numMergedOcc 0
12 mol 122 unq 0 iso 0 dist 4.38961 7.34585 3.65582 4.92712 6.80798 10.2878 numMergedOcc 0
13 mol 148 unq 0 iso 0 dist 8.6499 9.8506 13.5761 6.53248 6.81449 12.8245 numMergedOcc 0
14 mol 150 unq 0 iso 0 dist 8.75339 9.91991 13.6344 6.52303 6.87593 12.8352 numMergedOcc 0
15 mol 205 unq 0 iso 0 dist 8.8495 7.63908 7.54616 8.73701 8.25174 7.4185 numMergedOcc 0
16 mol 205 unq 1 iso 0 dist 8.00688 7.63908 3.69062 8.73701 9.16671 7.4185 numMergedOcc 0
17 mol 217 unq 0 iso 0 dist 6.00351 5.01648 3.59923 5.28844 8.99517 8.77705 numMergedOcc 0
18 mol 218 unq 0 iso 0 dist 8.59762 5.92364 5.45153 8.95992 7.68062 10.7766 numMergedOcc 0
19 mol 233 unq 0 iso 0 dist 8.69185 9.28828 6.37079 12.6841 9.69772 14.2725 numMergedOcc 0
20 mol 278 unq 0 iso 0 dist 8.31953 5.74676 3.86293 7.50969 9.93392 9.67239 numMergedOcc 0
