0 mol 58 unq 0 iso 0 dist 7.84983 11.5882 6.62496 16.5678 10.2241 9.58673 13.6875 9.9105 4.59417 8.98478 numMergedOcc 0
1 mol 58 unq 1 iso 0 dist 9.56737 11.5882 6.35756 16.5678 7.05413 9.58673 13.6875 7.17488 4.59417 8.98478 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 9.68526 8.31041 9.38498 9.51458 13.4082 8.70133 8.0072 6.23522 4.73407 7.78587 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 9.72442 11.7069 9.38498 10.9127 13.4082 8.70133 9.61302 6.23522 4.73407 7.78587 numMergedOcc 0
4 mol 73 unq 2 iso 0 dist 6.89722 10.4716 9.96396 6.4154 7.41074 8.70133 8.69689 11.3218 4.73407 7.78587 numMergedOcc 0
5 mol 73 unq 3 iso 0 dist 6.89722 5.2774 6.19304 6.4154 7.41074 4.65521 8.69689 11.3218 5.17781 7.78587 numMergedOcc 0
6 mol 73 unq 4 iso 0 dist 7.26679 8.31041 9.96396 9.51458 7.41074 8.70133 8.0072 11.3218 4.73407 7.78587 numMergedOcc 0
7 mol 73 unq 5 iso 0 dist 7.26679 5.44275 6.19304 9.51458 7.41074 4.65521 8.0072 11.3218 5.17781 7.78587 numMergedOcc 0
8 mol 73 unq 6 iso 0 dist 9.30776 8.31041 9.75218 9.51458 15.9882 8.70133 8.0072 12.8353 4.73407 7.78587 numMergedOcc 0
9 mol 92 unq 0 iso 0 dist 4.98104 10.7572 7.4729 11.3299 6.99832 5.81965 12.6253 9.68271 12.3859 7.03417 numMergedOcc 0
10 mol 92 unq 1 iso 0 dist 4.98104 5.50764 6.82344 11.3299 6.99832 9.70512 12.6253 9.68271 11.3622 7.03417 numMergedOcc 0
11 mol 102 unq 0 iso 0 dist 9.01767 6.42572 7.36792 11.9326 5.498 9.94856 8.94532 5.54256 3.48119 7.68537 numMergedOcc 0
12 mol 102 unq 1 iso 0 dist 9.80678 5.54551 7.36792 9.50209 5.498 9.94856 6.94341 5.54256 3.48119 7.68537 numMergedOcc 0
13 mol 127 unq 0 iso 0 dist 8.40046 9.75166 9.30299 8.03243 14.085 8.59981 11.4693 17.6043 14.8455 9.70065 numMergedOcc 0
14 mol 214 unq 0 iso 0 dist 8.49704 10.644 8.85478 6.35728 6.67959 7.46831 15.8573 12.5607 8.3225 9.86587 numMergedOcc 0
15 mol 222 unq 0 iso 0 dist 8.7347 4.28891 7.54212 5.04916 7.61682 7.18956 4.67688 12.2548 5.2269 9.29675 numMergedOcc 0
16 mol 234 unq 0 iso 0 dist 5.89084 4.74041 6.56247 10.6283 11.216 6.25105 17.6008 18.009 13.8525 7.91374 numMergedOcc 0
17 mol 234 unq 1 iso 0 dist 5.89084 6.16697 9.45496 14.0153 15.9563 9.5707 17.6008 18.009 12.7879 5.69634 numMergedOcc 0
18 mol 234 unq 2 iso 0 dist 5.89084 6.16697 9.45496 10.6283 11.216 7.85175 17.6008 18.009 12.7879 7.91374 numMergedOcc 0
19 mol 234 unq 3 iso 0 dist 8.47009 4.74041 9.36357 10.6283 11.4315 6.25105 17.6008 15.3921 13.8525 7.91374 numMergedOcc 0
20 mol 234 unq 4 iso 0 dist 8.47009 6.16697 6.7625 14.0153 14.4106 9.5707 17.6008 15.3921 12.7879 5.69634 numMergedOcc 0
21 mol 234 unq 5 iso 0 dist 8.47009 6.16697 6.7625 10.6283 11.4315 7.85175 17.6008 15.3921 12.7879 7.91374 numMergedOcc 0
22 mol 259 unq 0 iso 0 dist 7.93997 14.8465 7.46176 9.27954 5.79468 7.48005 17.4053 11.9533 6.65799 9.28024 numMergedOcc 0
23 mol 264 unq 0 iso 0 dist 6.75305 10.0289 6.24356 13.3898 9.67998 9.5784 18.7077 15.2551 11.147 8.56867 numMergedOcc 0
24 mol 264 unq 1 iso 0 dist 6.75305 10.0289 6.24356 13.3898 9.67998 9.5784 16.3357 13.3874 10.0018 6.29872 numMergedOcc 0
