0 mol 10 unq 0 iso 0 dist 8.00369 9.69704 6.18431 13.3259 9.61828 6.02543 13.5977 7.60549 6.77807 11.1583 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 4.90592 9.57743 5.80953 9.40479 6.99746 8.24948 9.65174 9.63925 7.7447 13.3652 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 9.36461 4.47891 5.80953 9.38831 6.99746 8.24948 11.5255 9.63925 7.7447 13.3652 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 6.74848 9.45442 6.81793 11.9636 5.66783 6.38243 13.5481 12.5394 8.97754 12.4814 numMergedOcc 0
4 mol 131 unq 0 iso 0 dist 5.39061 4.24991 7.75314 7.76594 5.66194 6.78801 4.48699 4.94367 8.49847 9.93041 numMergedOcc 0
5 mol 171 unq 0 iso 0 dist 8.1536 6.1593 7.47964 9.75627 11.6944 8.999 14.1672 8.77204 9.68512 11.6193 numMergedOcc 0
6 mol 186 unq 0 iso 0 dist 4.5271 6.38897 6.88127 8.12349 6.16503 8.31881 13.3578 13.2309 9.34653 9.09659 numMergedOcc 0
7 mol 194 unq 0 iso 0 dist 6.37788 5.28603 4.19371 5.52678 5.92931 5.53324 5.13892 3.7326 4.45769 7.82899 numMergedOcc 0
8 mol 194 unq 1 iso 0 dist 6.37788 5.28603 4.19371 5.52678 5.92931 5.53324 5.78717 7.29209 5.89939 10.0237 numMergedOcc 0
9 mol 194 unq 2 iso 0 dist 8.7028 11.0713 4.19371 9.81666 5.92931 5.53324 8.2232 3.7326 4.45769 7.82899 numMergedOcc 0
10 mol 194 unq 3 iso 0 dist 8.7028 11.0713 4.19371 9.81666 5.92931 5.53324 10.3448 7.29209 5.89939 10.0237 numMergedOcc 0
11 mol 252 unq 0 iso 0 dist 7.39391 4.34126 8.09509 11.8525 17.2823 9.39658 11.6079 11.8619 7.62991 10.4138 numMergedOcc 0
12 mol 252 unq 1 iso 0 dist 7.39391 4.34126 8.09509 11.8525 17.2823 9.39658 8.38453 3.99887 9.81261 19.1465 numMergedOcc 0
13 mol 252 unq 2 iso 0 dist 7.39391 4.34126 8.09509 8.55481 12.0545 5.9974 11.6079 11.8619 7.62991 6.33781 numMergedOcc 0
14 mol 252 unq 3 iso 0 dist 7.39391 4.34126 8.09509 8.55481 12.0545 5.9974 8.38453 3.99887 9.81261 14.8966 numMergedOcc 0
15 mol 260 unq 0 iso 0 dist 7.99521 5.38958 9.31888 8.3149 7.16782 9.50634 4.64695 7.28821 7.49606 4.05076 numMergedOcc 0
16 mol 266 unq 0 iso 0 dist 9.53943 5.67713 9.63518 12.2996 8.62248 8.20485 14.9464 13.8751 9.83672 5.48178 numMergedOcc 0
