0 mol 4 unq 0 iso 0 dist 7.00324 10.5475 8.24634 10.0302 7.14866 7.06429 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 9.62716 10.5475 9.16617 10.0302 5.50517 7.06429 numMergedOcc 0
2 mol 20 unq 0 iso 0 dist 6.29581 3.78339 7.51452 7.77627 3.61632 7.16149 numMergedOcc 0
3 mol 20 unq 1 iso 0 dist 6.29581 14.473 9.20198 14.6448 13.0142 9.4228 numMergedOcc 0
4 mol 20 unq 2 iso 0 dist 8.39179 3.78339 6.03547 7.77627 4.32143 7.16149 numMergedOcc 0
5 mol 20 unq 3 iso 0 dist 5.21143 6.18887 7.51452 6.12382 3.61632 7.16149 numMergedOcc 0
6 mol 20 unq 4 iso 0 dist 5.21143 12.502 9.20198 15.6248 13.0142 9.4228 numMergedOcc 0
7 mol 20 unq 5 iso 0 dist 5.75338 6.18887 6.03547 6.12382 4.32143 7.16149 numMergedOcc 0
8 mol 85 unq 0 iso 0 dist 5.20528 9.53239 9.82915 7.82214 4.58085 8.77199 numMergedOcc 0
9 mol 113 unq 0 iso 0 dist 8.49444 12.9469 8.8822 15.0887 13.1665 5.94552 numMergedOcc 0
10 mol 113 unq 1 iso 0 dist 5.55446 12.9469 9.66219 15.0887 12.3067 5.94552 numMergedOcc 0
11 mol 130 unq 0 iso 0 dist 7.35647 12.7556 7.7949 9.40368 3.76328 7.13306 numMergedOcc 0
12 mol 130 unq 1 iso 0 dist 4.88366 6.51295 7.7949 7.14034 3.76328 7.13306 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 5.31279 5.68485 7.66165 11.4254 7.69228 9.28036 numMergedOcc 0
14 mol 186 unq 1 iso 0 dist 6.19189 6.13422 7.76163 8.13982 7.65999 6.02579 numMergedOcc 0
15 mol 186 unq 2 iso 0 dist 8.34668 10.2733 7.76163 13.7845 7.65999 6.02579 numMergedOcc 0
16 mol 205 unq 0 iso 0 dist 6.32542 9.40714 6.03688 10.7382 9.6084 7.23959 numMergedOcc 0
17 mol 206 unq 0 iso 0 dist 9.24801 9.48802 8.0871 18.1456 15.182 9.73419 numMergedOcc 0
18 mol 206 unq 1 iso 0 dist 9.24801 9.48802 8.0871 16.5693 9.80396 9.99824 numMergedOcc 0
19 mol 234 unq 0 iso 0 dist 5.74541 5.28657 6.30154 12.914 14.0878 9.18589 numMergedOcc 0
20 mol 265 unq 0 iso 0 dist 7.87337 10.3482 6.71375 19.3432 13.9004 9.91497 numMergedOcc 0
21 mol 265 unq 1 iso 0 dist 7.87337 10.3482 6.71375 16.7813 10.3547 8.2179 numMergedOcc 0
22 mol 287 unq 0 iso 0 dist 8.25538 11.7745 6.89451 12.6727 5.41757 9.29241 numMergedOcc 0
23 mol 288 unq 0 iso 0 dist 8.25538 11.7745 6.89451 12.6727 5.41757 9.29241 numMergedOcc 0
24 mol 289 unq 0 iso 0 dist 8.25538 11.7745 6.89451 12.6727 5.41757 9.29241 numMergedOcc 0
