0 mol 43 unq 0 iso 0 dist 8.06275 8.74209 5.41726 9.83489 8.03754 12.8366 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 6.72872 7.72041 4.02037 5.56571 9.20429 8.73588 numMergedOcc 0
2 mol 55 unq 0 iso 0 dist 7.62383 9.79757 8.39998 12.4883 8.97965 17.0273 numMergedOcc 0
3 mol 55 unq 1 iso 0 dist 6.81152 8.3736 9.9157 8.95606 6.65254 12.0135 numMergedOcc 0
4 mol 68 unq 0 iso 0 dist 5.9651 6.09085 7.50975 8.88456 9.40333 7.50377 numMergedOcc 0
5 mol 70 unq 0 iso 0 dist 6.77833 8.63204 12.7012 5.81368 9.74802 12.5945 numMergedOcc 0
6 mol 70 unq 1 iso 0 dist 6.77833 5.4014 8.20805 5.81368 9.74802 10.749 numMergedOcc 0
7 mol 70 unq 2 iso 0 dist 9.83265 9.19079 12.7012 3.88245 9.74802 12.5945 numMergedOcc 0
8 mol 70 unq 3 iso 0 dist 9.83265 8.37742 8.20805 3.88245 9.74802 10.749 numMergedOcc 0
9 mol 78 unq 0 iso 0 dist 9.29446 8.56119 9.76194 5.64101 5.68286 10.4541 numMergedOcc 0
10 mol 109 unq 0 iso 0 dist 9.26438 6.62354 5.00433 16.2476 9.41191 14.206 numMergedOcc 0
11 mol 109 unq 1 iso 0 dist 6.43255 8.00085 5.00433 9.88245 9.41191 14.206 numMergedOcc 0
12 mol 122 unq 0 iso 0 dist 8.47907 6.91978 6.9791 14.9119 8.75778 15.5348 numMergedOcc 0
13 mol 134 unq 0 iso 0 dist 9.42271 7.76446 15.9138 10.9017 8.86784 15.5741 numMergedOcc 0
14 mol 134 unq 1 iso 0 dist 9.42271 6.14652 12.3479 10.9017 8.86784 15.2447 numMergedOcc 0
15 mol 152 unq 0 iso 0 dist 8.34839 9.4275 5.39112 8.6893 8.41774 12.9285 numMergedOcc 0
16 mol 152 unq 1 iso 0 dist 8.34839 9.83462 4.84714 8.6893 8.41774 11.2309 numMergedOcc 0
17 mol 154 unq 0 iso 0 dist 7.34207 8.59532 13.5599 6.84292 6.36439 14.5179 numMergedOcc 0
18 mol 162 unq 0 iso 0 dist 5.21803 9.71155 5.65603 5.58809 7.69229 9.65468 numMergedOcc 0
19 mol 178 unq 0 iso 0 dist 8.04723 8.81097 10.8373 8.33307 9.63185 16.4833 numMergedOcc 0
20 mol 229 unq 0 iso 0 dist 6.88694 9.90415 7.22525 5.19315 8.83023 14.0673 numMergedOcc 0
21 mol 229 unq 1 iso 0 dist 6.88694 6.92268 4.92403 5.19315 8.83023 9.60329 numMergedOcc 0
22 mol 233 unq 0 iso 0 dist 6.48196 7.69531 5.65362 4.26152 7.41931 10.0877 numMergedOcc 0
23 mol 236 unq 0 iso 0 dist 8.95071 5.9625 10.5937 5.81446 5.90804 8.75172 numMergedOcc 0
24 mol 277 unq 0 iso 0 dist 7.23956 9.22453 3.97543 10.2688 4.81916 6.42951 numMergedOcc 0
