0 mol 5 unq 0 iso 0 dist 7.0627 8.35174 5.69239 13.2742 8.39424 5.44356 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 7.62938 5.17677 7.64769 7.64048 5.8674 5.63302 numMergedOcc 0
2 mol 5 unq 2 iso 0 dist 7.62938 8.12453 8.68577 7.64048 5.8674 4.55639 numMergedOcc 0
3 mol 5 unq 3 iso 0 dist 7.62938 5.58988 9.70883 7.64048 5.8674 5.70163 numMergedOcc 0
4 mol 33 unq 0 iso 0 dist 9.06004 6.82054 4.78873 7.77567 6.33349 8.45145 numMergedOcc 0
5 mol 120 unq 0 iso 0 dist 8.93999 8.26567 6.98791 14.6456 6.10769 9.43682 numMergedOcc 0
6 mol 123 unq 0 iso 0 dist 9.85144 8.75597 5.36214 16.717 10.7803 8.24171 numMergedOcc 0
7 mol 123 unq 1 iso 0 dist 9.85144 8.75597 5.36214 9.43033 9.94939 5.38148 numMergedOcc 0
8 mol 123 unq 2 iso 0 dist 9.85144 8.75597 5.36214 14.3461 5.79985 6.63094 numMergedOcc 0
9 mol 123 unq 3 iso 0 dist 5.80266 7.36026 5.36214 9.50933 10.7803 8.24171 numMergedOcc 0
10 mol 123 unq 4 iso 0 dist 5.80266 7.36026 5.36214 12.7002 9.94939 5.38148 numMergedOcc 0
11 mol 123 unq 5 iso 0 dist 5.80266 7.36026 5.36214 8.57379 5.79985 6.63094 numMergedOcc 0
12 mol 123 unq 6 iso 0 dist 5.18305 6.45068 5.56127 5.87154 3.00129 8.24171 numMergedOcc 0
13 mol 123 unq 7 iso 0 dist 5.18305 6.45068 5.56127 11.4423 8.56894 5.38148 numMergedOcc 0
14 mol 123 unq 8 iso 0 dist 5.18305 6.45068 5.56127 6.82663 5.2546 6.63094 numMergedOcc 0
15 mol 123 unq 9 iso 0 dist 6.78431 6.45068 5.36214 5.87154 10.7803 8.24171 numMergedOcc 0
16 mol 123 unq 10 iso 0 dist 6.78431 6.45068 5.36214 11.4423 9.94939 5.38148 numMergedOcc 0
17 mol 123 unq 11 iso 0 dist 6.78431 6.45068 5.36214 6.82663 5.79985 6.63094 numMergedOcc 0
18 mol 123 unq 12 iso 0 dist 6.60464 6.36283 5.36214 13.1465 10.7803 8.24171 numMergedOcc 0
19 mol 123 unq 13 iso 0 dist 6.60464 6.36283 5.36214 9.93167 9.94939 5.38148 numMergedOcc 0
20 mol 123 unq 14 iso 0 dist 6.60464 6.36283 5.36214 11.4155 5.79985 6.63094 numMergedOcc 0
21 mol 169 unq 0 iso 0 dist 8.80004 9.55863 5.10589 10.4826 6.05322 9.39809 numMergedOcc 0
22 mol 169 unq 1 iso 0 dist 8.80004 4.68959 4.63336 10.4826 6.05322 8.38775 numMergedOcc 0
23 mol 176 unq 0 iso 0 dist 6.95058 4.99447 6.85902 8.8556 5.64063 5.58647 numMergedOcc 0
24 mol 184 unq 0 iso 0 dist 9.35481 10.2778 9.21536 7.90504 4.06997 6.79615 numMergedOcc 0
25 mol 250 unq 0 iso 0 dist 8.45998 15.0409 9.81716 16.0363 8.03648 8.50251 numMergedOcc 0
26 mol 260 unq 0 iso 0 dist 8.56451 5.45648 7.04263 10.4704 7.79959 9.68243 numMergedOcc 0
27 mol 283 unq 0 iso 0 dist 8.3831 5.93642 7.31132 9.40332 12.6476 9.90494 numMergedOcc 0
28 mol 283 unq 1 iso 0 dist 8.3831 5.93642 7.31132 5.8676 3.31521 5.90121 numMergedOcc 0
29 mol 284 unq 0 iso 0 dist 4.69611 3.39008 5.6964 10.7215 8.65336 8.82497 numMergedOcc 0
