0 mol 85 unq 0 iso 0 dist 8.58689 8.82052 4.34173 11.3448 12.5012 9.55766 numMergedOcc 0
1 mol 85 unq 1 iso 0 dist 7.82214 8.82052 6.47761 11.3448 14.8236 9.55766 numMergedOcc 0
2 mol 109 unq 0 iso 0 dist 9.39787 8.39026 14.3419 7.68493 11.008 7.73993 numMergedOcc 0
3 mol 120 unq 0 iso 0 dist 5.27549 8.51585 4.80028 5.58087 7.82186 8.40669 numMergedOcc 0
4 mol 154 unq 0 iso 0 dist 5.7306 6.03116 3.44683 10.3386 8.9675 6.31314 numMergedOcc 0
5 mol 163 unq 0 iso 0 dist 5.43385 8.74174 5.57459 11.4143 6.35103 9.29539 numMergedOcc 0
6 mol 163 unq 1 iso 0 dist 5.43385 8.74174 5.57459 17.622 14.1782 9.02124 numMergedOcc 0
7 mol 173 unq 0 iso 0 dist 8.12102 7.87322 11.8803 5.43254 7.90789 4.0037 numMergedOcc 0
8 mol 173 unq 1 iso 0 dist 7.95138 7.87322 6.94278 5.43254 4.13397 4.0037 numMergedOcc 0
9 mol 195 unq 0 iso 0 dist 8.77346 8.22643 12.7228 8.61846 15.8063 5.46768 numMergedOcc 0
10 mol 206 unq 0 iso 0 dist 6.28518 7.47477 9.9437 11.0055 16.2534 8.47911 numMergedOcc 0
11 mol 206 unq 1 iso 0 dist 6.09565 8.65572 12.9835 5.67721 9.50203 8.47911 numMergedOcc 0
12 mol 229 unq 0 iso 0 dist 9.64316 7.09453 4.77424 15.1667 10.8358 9.3376 numMergedOcc 0
13 mol 229 unq 1 iso 0 dist 7.69711 8.69109 4.77424 14.9255 10.8358 9.3376 numMergedOcc 0
14 mol 260 unq 0 iso 0 dist 6.57555 8.2776 4.933 6.39739 8.99274 8.54084 numMergedOcc 0
