0 mol 33 unq 0 iso 0 dist 7.15141 9.06004 8.39877 6.53932 10.0784 7.89306 numMergedOcc 0
1 mol 33 unq 1 iso 0 dist 7.15141 9.34266 5.85188 6.53932 10.0784 8.36697 numMergedOcc 0
2 mol 42 unq 0 iso 0 dist 7.06199 8.98545 3.53534 10.2834 8.52254 7.53194 numMergedOcc 0
3 mol 53 unq 0 iso 0 dist 8.61163 7.77212 5.8646 6.31644 12.8059 9.52717 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 7.51978 7.18148 13.8618 9.69903 14.3756 6.81735 numMergedOcc 0
5 mol 91 unq 0 iso 0 dist 7.28711 8.47126 9.80027 14.1047 12.2123 8.91998 numMergedOcc 0
6 mol 143 unq 0 iso 0 dist 8.72463 7.99127 6.75249 4.42628 12.703 9.99012 numMergedOcc 0
7 mol 143 unq 1 iso 0 dist 8.72463 7.99127 6.75249 12.8171 7.5984 5.33772 numMergedOcc 0
8 mol 143 unq 2 iso 0 dist 6.7319 8.19373 7.02542 5.10341 8.11202 9.12935 numMergedOcc 0
9 mol 167 unq 0 iso 0 dist 4.93984 7.33483 6.13061 4.72853 8.58946 8.43955 numMergedOcc 0
10 mol 167 unq 1 iso 0 dist 6.64164 9.5648 12.8624 10.2953 15.9047 8.06817 numMergedOcc 0
11 mol 204 unq 0 iso 0 dist 7.92766 7.8518 6.49075 3.96829 7.7292 6.46946 numMergedOcc 0
12 mol 204 unq 1 iso 0 dist 6.32652 7.8518 8.62057 3.96829 6.27396 6.46946 numMergedOcc 0
13 mol 214 unq 0 iso 0 dist 8.3035 6.03628 4.15355 10.8341 9.4835 9.46274 numMergedOcc 0
14 mol 217 unq 0 iso 0 dist 9.55587 8.92812 5.62746 8.23649 5.10683 7.94351 numMergedOcc 0
15 mol 249 unq 0 iso 0 dist 6.93507 6.32658 5.57138 8.73111 11.6265 6.62413 numMergedOcc 0
16 mol 249 unq 1 iso 0 dist 6.42827 6.32658 10.3504 8.73111 14.5656 6.62413 numMergedOcc 0
17 mol 253 unq 0 iso 0 dist 5.76077 8.86676 9.46115 9.07394 8.53729 6.93942 numMergedOcc 0
18 mol 253 unq 1 iso 0 dist 5.76077 8.86676 9.46115 11.6981 8.07341 9.31626 numMergedOcc 0
19 mol 265 unq 0 iso 0 dist 4.96568 9.19805 5.94366 11.7587 7.54805 6.18698 numMergedOcc 0
20 mol 287 unq 0 iso 0 dist 7.28096 6.17759 7.83168 9.16384 13.6466 9.77996 numMergedOcc 0
21 mol 287 unq 1 iso 0 dist 7.28096 8.20391 10.0322 9.16384 13.6466 6.61308 numMergedOcc 0
22 mol 288 unq 0 iso 0 dist 7.28096 6.17759 7.83168 9.16384 13.6466 9.77996 numMergedOcc 0
23 mol 288 unq 1 iso 0 dist 7.28096 8.20391 10.0322 9.16384 13.6466 6.61308 numMergedOcc 0
24 mol 289 unq 0 iso 0 dist 7.28096 6.17759 7.83168 9.16384 13.6466 9.77996 numMergedOcc 0
25 mol 289 unq 1 iso 0 dist 7.28096 8.20391 10.0322 9.16384 13.6466 6.61308 numMergedOcc 0
