0 mol 12 unq 0 iso 0 dist 8.09419 7.41387 9.20201 9.86138 4.98378 6.65398 numMergedOcc 0
1 mol 12 unq 1 iso 0 dist 7.86307 6.5386 9.20201 5.76006 4.98378 6.65398 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 9.36326 6.10541 5.88852 15.6939 9.78721 9.65131 numMergedOcc 0
3 mol 25 unq 1 iso 0 dist 9.36326 6.10541 5.88852 11.7614 5.65976 8.73572 numMergedOcc 0
4 mol 41 unq 0 iso 0 dist 7.41523 12.9916 6.59367 16.9184 10.9877 8.28673 numMergedOcc 0
5 mol 54 unq 0 iso 0 dist 6.5784 6.29913 5.53875 10.9061 4.94373 6.79881 numMergedOcc 0
6 mol 55 unq 0 iso 0 dist 6.32571 4.13365 8.37045 6.71884 5.80038 9.30367 numMergedOcc 0
7 mol 55 unq 1 iso 0 dist 6.49013 6.59267 7.01944 9.25575 4.11996 6.67079 numMergedOcc 0
8 mol 55 unq 2 iso 0 dist 6.49013 6.59267 7.01944 9.75286 5.27768 7.14636 numMergedOcc 0
9 mol 64 unq 0 iso 0 dist 9.31622 9.65826 8.64746 8.00221 5.78769 7.24183 numMergedOcc 0
10 mol 74 unq 0 iso 0 dist 8.47441 6.01245 7.41639 10.3008 4.86866 7.33612 numMergedOcc 0
11 mol 115 unq 0 iso 0 dist 9.36283 10.165 9.99454 17.2692 14.5771 9.95726 numMergedOcc 0
12 mol 130 unq 0 iso 0 dist 7.87306 9.91168 8.67153 10.4929 7.89412 6.54338 numMergedOcc 0
13 mol 130 unq 1 iso 0 dist 7.87306 9.91168 8.67153 10.2502 5.1247 9.39135 numMergedOcc 0
14 mol 130 unq 2 iso 0 dist 7.87306 4.71008 8.98551 12.8618 12.8248 8.50054 numMergedOcc 0
15 mol 130 unq 3 iso 0 dist 7.87306 4.71008 8.98551 10.4929 7.89412 7.47653 numMergedOcc 0
16 mol 130 unq 4 iso 0 dist 7.87306 4.71008 8.98551 10.2502 5.1247 8.97124 numMergedOcc 0
17 mol 220 unq 0 iso 0 dist 5.02756 9.07015 9.49722 12.9573 12.5157 7.57716 numMergedOcc 0
18 mol 220 unq 1 iso 0 dist 5.02756 9.07015 9.49722 8.98518 5.34316 8.98362 numMergedOcc 0
19 mol 238 unq 0 iso 0 dist 9.13022 4.63444 6.40309 5.59164 6.23871 5.57184 numMergedOcc 0
20 mol 258 unq 0 iso 0 dist 8.20751 5.83092 6.73928 7.42888 5.28906 8.97411 numMergedOcc 0
21 mol 266 unq 0 iso 0 dist 6.41474 5.26607 5.45375 7.87939 4.75686 8.61786 numMergedOcc 0
22 mol 266 unq 1 iso 0 dist 6.41474 5.26607 5.45375 12.7807 10.3992 8.42706 numMergedOcc 0
