0 mol 34 unq 0 iso 0 dist 9.29561 8.23162 9.27276 6.68767 6.72467 11.9657 numMergedOcc 0
1 mol 34 unq 1 iso 0 dist 9.29561 6.57908 10.0379 6.68767 6.72467 8.55901 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 8.82919 4.93077 9.60531 17.4568 9.20253 17.3289 numMergedOcc 0
3 mol 61 unq 0 iso 0 dist 4.4866 9.01453 4.83002 6.85145 9.20885 11.699 numMergedOcc 0
4 mol 105 unq 0 iso 0 dist 8.22695 6.60484 5.74792 11.7644 7.81122 6.50017 numMergedOcc 0
5 mol 114 unq 0 iso 0 dist 8.25015 8.50045 16.6737 4.51826 6.71591 11.2986 numMergedOcc 0
6 mol 114 unq 1 iso 0 dist 8.25015 7.90329 15.2678 4.51826 6.71591 11.9466 numMergedOcc 0
7 mol 114 unq 2 iso 0 dist 8.25015 9.31512 5.01204 4.51826 6.71591 8.87941 numMergedOcc 0
8 mol 127 unq 0 iso 0 dist 7.88328 8.97156 10.5932 4.95538 5.45159 6.3244 numMergedOcc 0
9 mol 127 unq 1 iso 0 dist 5.33851 8.97156 7.76684 4.95538 4.9835 6.3244 numMergedOcc 0
10 mol 194 unq 0 iso 0 dist 4.4558 6.29314 8.17436 5.65101 6.8093 6.41318 numMergedOcc 0
11 mol 227 unq 0 iso 0 dist 6.86845 9.187 6.0465 5.38513 6.37369 6.152 numMergedOcc 0
12 mol 233 unq 0 iso 0 dist 8.41604 9.38859 5.19718 6.99665 5.64376 9.2911 numMergedOcc 0
13 mol 260 unq 0 iso 0 dist 5.16772 8.76664 6.04407 4.91827 7.58405 9.72517 numMergedOcc 0
14 mol 260 unq 1 iso 0 dist 5.16772 8.76664 6.04407 8.29529 7.26115 9.97652 numMergedOcc 0
15 mol 260 unq 2 iso 0 dist 5.16772 9.00987 8.32254 4.91827 7.58405 13.4375 numMergedOcc 0
16 mol 260 unq 3 iso 0 dist 5.16772 9.00987 8.32254 8.29529 7.26115 14.0525 numMergedOcc 0
17 mol 283 unq 0 iso 0 dist 6.28768 9.41532 8.66166 4.50624 9.54992 13.5551 numMergedOcc 0
